SCHEMBL13177177

SCHEMBL13177177

COC(C)c1ccccc1-c1ccc2[nH]c(/C=C/c3ccc(OC(C(F)(F)F)C(F)(F)F)cc3)nc2c1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ TRPV1 Q8NER1 19/20 0.52
▸ TP53 P04637 1/20 0.40
▸ MAPT P10636 1/20 0.40

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
SCHEMBL1800544 0.90 TRPV1 (0.65) TRPV1
SCHEMBL1800537 0.90 TRPV1 (0.65) TRPV1
SCHEMBL12350092 0.84 TRPV1 (0.66) TRPV1
SCHEMBL1793824 0.83 TRPV1 (0.68) TRPV1
SCHEMBL1793828 0.83 TRPV1 (0.68) TRPV1
SCHEMBL1801723 0.82 TRPV1 (0.64) TRPV1
SCHEMBL1801720 0.82 TRPV1 (0.64) TRPV1
SCHEMBL1802379 0.81 TRPV1 (0.68) TRPV1
SCHEMBL1802382 0.81 TRPV1 (0.68) TRPV1
SCHEMBL1796863 0.80 TRPV1 (0.70) 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 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 disclosed
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