SCHEMBL2851967

SCHEMBL2851967

COc1cc(CNC(=O)C=Cc2ccc(C(C)(C)C)cc2)ccc1O

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.67
TYR P14679 2/20 0.58
ACHE P22303 1/20 0.57

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
SCHEMBL2851960 1.00 TRPV1 (0.67) TRPV1TYRACHE
SCHEMBL2855584 0.89 TYR (0.58) TRPV1TYRACHE
SCHEMBL2855581 0.89 TYR (0.58) TRPV1TYRACHE
SCHEMBL802713 0.89 ABCB1 (0.65) TRPV1TYRACHE
SCHEMBL12299018 0.88 TYR (0.73) TRPV1TYRACHE
SCHEMBL1916293 0.88 TYR (0.73) TRPV1TYRACHE
SCHEMBL2847211 0.87 TYR (0.61) TRPV1TYRACHE
SCHEMBL2847215 0.87 TYR (0.61) TRPV1TYRACHE
SCHEMBL2853922 0.87 MAPT (0.65) TRPV1TYRACHE
SCHEMBL2853919 0.87 MAPT (0.65) TRPV1TYRACHE

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1778622-B1 PARA-ALKYL-SUBSTITUTED N-(4-HYDROXY-3-METHOXY-BENZYL) CINNAMAMIDES AND THE USE THEREOF FOR PRODUCING DRUGS GRUENENTHAL GMBH (DE) 2010-01-13 EP claimed