SCHEMBL3072831

SCHEMBL3072831

NS(=O)(=O)Cc1ccccc1-c1ccc2[nH]c(C3CC3c3ccc(OC(C(F)(F)F)C(F)(F)F)cc3)nc2c1

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ ALOX5AP P20292 1/20 0.35
▸ FEN1 P39748 1/20 0.35
▸ TRPV1 Q8NER1 2/20 0.32

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
SCHEMBL1794781 0.88 TRPV1 (0.42) ALOX5APFEN1TRPV1
SCHEMBL1798733 0.82 TRPV1 (0.45) ALOX5APFEN1TRPV1
SCHEMBL1794423 0.82 ALOX5AP (0.38) ALOX5APFEN1TRPV1
SCHEMBL1798102 0.81 TRPV1 (0.39) ALOX5APFEN1TRPV1
SCHEMBL12350216 0.81 TRPV1 (0.42) ALOX5APFEN1TRPV1
SCHEMBL1799525 0.80 TRPV1 (0.39) TRPV1
SCHEMBL1795829 0.80 TRPV1 (0.42) TRPV1
SCHEMBL1801367 0.77 TRPV1 (0.54) TRPV1
SCHEMBL1797862 0.76 TRPV1 (0.44) ALOX5APFEN1TRPV1
SCHEMBL12350213 0.76 TRPV1 (0.45) ALOX5APFEN1TRPV1

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-2021330-B1 BENZIMIDAZOLE MODULATORS OF VR1 JANSSEN PHARMACEUTICA NV (BE) 2010-09-22 — — EP claimed
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