SCHEMBL382280

SCHEMBL382280

Cc1cc(C(=S)Nc2ccccc2)c2ccc(-c3ccc([C@H]4CC[C@H](CC(=O)O)CC4)cc3)cc2n1

nearest known ligand 0.84

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 19/20 0.84
SOAT2 O75908 4/20 0.84
SOAT1 P35610 2/20 0.64
CYP2C9 P11712 1/20 0.48
DGAT2 Q96PD7 1/20 0.48

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
SCHEMBL382279 1.00 DGAT1 (0.84) DGAT1SOAT2SOAT1CYP2C9DGAT2
SCHEMBL10198189 1.00 DGAT1 (0.84) DGAT1SOAT2SOAT1CYP2C9DGAT2
SCHEMBL10198057 0.91 DGAT1 (1.00) DGAT1SOAT2SOAT1CYP2C9DGAT2
SCHEMBL384253 0.91 DGAT1 (1.00) DGAT1SOAT2SOAT1CYP2C9DGAT2
SCHEMBL384252 0.91 DGAT1 (1.00) DGAT1SOAT2SOAT1CYP2C9DGAT2
SCHEMBL409397 0.85 DGAT1 (0.88) DGAT1SOAT2SOAT1
SCHEMBL10260785 0.85 DGAT1 (0.88) DGAT1SOAT2SOAT1
SCHEMBL409396 0.85 DGAT1 (0.88) DGAT1SOAT2SOAT1
SCHEMBL10198330 0.84 DGAT1 (0.87) DGAT1SOAT2SOAT1
SCHEMBL10197410 0.83 DGAT1 (0.85) DGAT1SOAT2SOAT1

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-2408744-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE Schering Corporation (US) 2012-01-25 EP disclosed
WO-2010107768-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2010-09-23 WO disclosed