SCHEMBL14137104

SCHEMBL14137104

Nc1ccc(-c2ccc3c(c2)CCC(O)(CC(=O)O)C3=O)cc1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 19/20 0.50
▸ TDP2 O95551 1/20 0.43

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
SCHEMBL14137079 0.84 DGAT1 (0.69) DGAT1
SCHEMBL14062046 0.84 DGAT1 (0.46) DGAT1TDP2
SCHEMBL14137109 0.83 DGAT1 (0.49) DGAT1
SCHEMBL14137083 0.82 DGAT1 (0.70) DGAT1
SCHEMBL14060558 0.80 DGAT1 (0.74) DGAT1
SCHEMBL14060252 0.76 DGAT1 (0.78) DGAT1
SCHEMBL14060035 0.76 DGAT1 (0.81) DGAT1
SCHEMBL14059600 0.75 DGAT1 (0.63) DGAT1
SCHEMBL14137107 0.74 DGAT1 (0.79) DGAT1
SCHEMBL18746423 0.73 EPHX2 (0.40) DGAT1

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-2012162127-A1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2012-11-29 — — WO disclosed
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