SCHEMBL3465559

SCHEMBL3465559

CN(c1ccc(C(CCc2ccc(C(F)(F)F)cc2SC2CCCCC2)CNC(=O)c2ccccc2O)cc1F)S(C)(=O)=O

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL3465737 0.95 TRPV1 (0.47) TRPV1
SCHEMBL3465734 0.78 ESRRG (0.48) TRPV1
SCHEMBL3467245 0.78 TRPV1 (0.47) TRPV1
SCHEMBL3465556 0.78 TRPV1 (0.75) TRPV1
SCHEMBL2531659 0.75 TRPV1 (0.48) TRPV1
SCHEMBL2526774 0.74 TRPV1 (0.62) TRPV1
SCHEMBL2527940 0.73 TRPV1 (0.52) TRPV1
SCHEMBL2532669 0.72 TRPV1 (0.57) TRPV1
SCHEMBL2531834 0.72 TRPV1 (0.49) TRPV1
SCHEMBL2530159 0.72 TRPV1 (0.60) TRPV1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2146959-A1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS Grünenthal GmbH (DE) 2010-01-27 EP claimed
WO-2008125296-A1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS Grünenthal GmbH (DE) 2008-10-23 WO claimed
EP-2146959-B1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS GRUENENTHAL GMBH (DE) 2013-06-19 EP disclosed
EP-2146959-A1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS Grünenthal GmbH (DE) 2010-01-27 EP disclosed
WO-2008125296-A1 VANILLOID RECEPTOR LIGANDS AND THE USE THEREOF FOR THE PRODUCTION OF PHARMACEUTICALS Grünenthal GmbH (DE) 2008-10-23 WO disclosed