SCHEMBL2414913

SCHEMBL2414913

CC(C)NC(=O)c1noc(-c2ccc(C(C)(C)C)cc2)c1Cl

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 20/20 0.55

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
Trifluoroacetic Acid SCHEMBL1686364 0.94 TRPV1 (0.55) TRPV1
SCHEMBL1686282 0.89 TRPV1 (0.69) TRPV1
SCHEMBL1686463 0.81 TRPV1 (0.49) TRPV1
SCHEMBL1686559 0.81 TRPV1 (0.80) TRPV1
SCHEMBL2419321 0.81 TRPV1 (0.80) TRPV1
SCHEMBL2450012 0.80 TRPV1 (0.80) TRPV1
SCHEMBL1686352 0.80 TRPV1 (0.63) TRPV1
SCHEMBL1686273 0.80 TRPV1 (0.72) TRPV1
SCHEMBL1686272 0.80 TRPV1 (0.72) TRPV1
SCHEMBL1686353 0.80 TRPV1 (0.63) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2185530-B1 5-PHENYL-ISOXAZOLE-3-CARBOXAMIDE DERIVATIVES AS TRPV1 MODULATORS ORGANON NV (NL) 2011-09-14 EP claimed
EP-2185530-B1 5-PHENYL-ISOXAZOLE-3-CARBOXAMIDE DERIVATIVES AS TRPV1 MODULATORS ORGANON NV (NL) 2011-09-14 EP disclosed