SCHEMBL14972753

SCHEMBL14972753

Cc1oc2c(c1CC(=O)Nc1nc(-c3cccc(Cl)c3C(F)(F)F)cs1)c(=O)n(C)c(=O)n2C

nearest known ligand 0.77

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 20/20 0.77
▸ TRPV4 Q9HBA0 4/20 0.71
▸ TRPV3 Q8NET8 2/20 0.71
▸ TRPV1 Q8NER1 1/20 0.71

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
SCHEMBL10275599 0.90 TRPA1 (0.73) TRPA1TRPV4TRPV3TRPV1
SCHEMBL10275261 0.87 TRPA1 (1.00) TRPA1TRPV4TRPV3TRPV1
SCHEMBL10275387 0.85 TRPA1 (1.00) TRPA1TRPV4TRPV3TRPV1
SCHEMBL10275088 0.83 TRPA1 (0.70) TRPA1TRPV4TRPV3TRPV1
SCHEMBL10275058 0.83 TRPA1 (0.89) TRPA1TRPV4TRPV3TRPV1
SCHEMBL10275068 0.83 TRPA1 (1.00) TRPA1TRPV4TRPV3TRPV1
SCHEMBL10275835 0.83 TRPA1 (0.80) TRPA1TRPV4TRPV3TRPV1
SCHEMBL9932587 0.83 TRPA1 (1.00) TRPA1TRPV4TRPV3TRPV1
SCHEMBL10275098 0.83 TRPA1 (1.00) TRPA1TRPV4TRPV3TRPV1
SCHEMBL10275100 0.83 TRPA1 (0.72) TRPA1TRPV4TRPV3TRPV1

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-2411395-B1 FUROPYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS SA (CH) 2013-05-29 — — EP claimed
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