Synthesis and Structure-Activity Relationships of Triazaspirodecanone Derivatives as Nociceptin/Orphanin FQ Receptor Ligands

Chem Biol Drug Des. 2015 Oct;86(4):447-58. doi: 10.1111/cbdd.12505. Epub 2015 Jan 20.

Abstract

Several spiroxatrine derivatives were synthesized and evaluated as potential NOP receptor ligands. Structural modifications of the 1,4-benzodioxane moiety of spiroxatrine have been the focus of this research project. The structure-activity relationships that emerged indicate that the presence of an H-bond donor group (hydroxyl group) is more favorable for NOP activity when it is positioned α with respect to the CH2 linked to the 1-phenyl-1,3,8-triaza-spiro[4.5]decan-4-one portion. Moreover, cis diastereoisomers of the hydroxyl derivatives4 and 22 show a moderately higher degree of stereoselectivity than trans isomers. In particular, the spiropiperidine derivative cis-4 has submicromolar agonistic activity, and it will be the reference compound for the design and synthesis of new NOP agonists.

Keywords: NOP ligands; ORL-1; agonists; spiroxatrine; triazaspirodecanone.

MeSH terms

  • Animals
  • Aza Compounds* / chemical synthesis
  • Aza Compounds* / chemistry
  • Humans
  • Ligands
  • Molecular Structure
  • Nociceptin Receptor
  • Receptors, Opioid / agonists*
  • Spiro Compounds* / chemical synthesis
  • Spiro Compounds* / chemistry
  • Structure-Activity Relationship

Substances

  • Aza Compounds
  • Ligands
  • Receptors, Opioid
  • Spiro Compounds
  • spirodecanone
  • Nociceptin Receptor
  • OPRL1 protein, human