SCHEMBL13190509

SCHEMBL13190509

Cn1c(=O)[nH]c2snc(CC(=O)Nc3nc(-c4cc(F)cc(C(F)(F)F)c4)cs3)c2c1=O

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 20/20 0.75
▸ TRPV4 Q9HBA0 11/20 0.75
▸ TRPV3 Q8NET8 3/20 0.50
▸ TRPV1 Q8NER1 1/20 0.50

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
SCHEMBL1689545 0.86 TRPA1 (1.00) TRPA1TRPV4TRPV3TRPV1
SCHEMBL13190347 0.85 TRPA1 (0.75) TRPA1TRPV4TRPV3TRPV1
SCHEMBL13190351 0.84 TRPA1 (0.60) TRPA1TRPV4TRPV3TRPV1
SCHEMBL14305979 0.81 TRPA1 (0.75) TRPA1TRPV4TRPV3TRPV1
SCHEMBL13190349 0.81 TRPA1 (0.75) TRPA1TRPV4TRPV3TRPV1
SCHEMBL1689539 0.79 TRPA1 (0.84) TRPA1TRPV4TRPV3TRPV1
SCHEMBL13075869 0.78 TRPA1 (0.73) TRPA1TRPV4TRPV3
SCHEMBL3813827 0.78 TRPA1 (0.73) TRPA1TRPV4TRPV3
SCHEMBL13190350 0.78 TRPA1 (0.60) TRPA1TRPV4TRPV3TRPV1
SCHEMBL474733 0.78 TRPA1 (0.77) TRPA1TRPV4TRPV3

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
WO-2010109328-A1 ISOTHIAZOLO-PYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS, S.A. (CH) 2010-09-30 — — WO disclosed
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