SCHEMBL7845259

SCHEMBL7845259

SC1=Cc2ccccc2SN=C1

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 1/20 0.33
GPR84 Q9NQS5 1/20 0.30

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
SCHEMBL7849227 0.76 TRPA1 (0.33) TRPA1GPR84
SCHEMBL7847311 0.72 GPR84 (0.41) TRPA1GPR84
SCHEMBL20145049 0.67 TRPA1 (0.39) TRPA1
SCHEMBL8555 0.67 TRPA1 (0.35) TRPA1GPR84
SCHEMBL3650633 0.66 TRPA1 (0.33) TRPA1
SCHEMBL7851348 0.65 L3MBTL1 (0.35)
SCHEMBL7852096 0.63 ALDH1A1 (0.39)
SCHEMBL19983 0.63 TRPA1 (0.31) TRPA1
SCHEMBL29901519 0.63 TRPA1 (0.31) TRPA1
SCHEMBL433359 0.61 TRPA1 (0.31) TRPA1

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-1155007-A2 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES G.D. Searle LLC (US) 2001-11-21 EP disclosed
WO-2000047568-A2 1,2-BENZOTHIAZEPINES FOR THE TREATMENT OF HYPERLIPIDEMIC DISEASES G.D. SEARLE LLC (US) 2000-08-17 WO disclosed