SCHEMBL13190286

SCHEMBL13190286

O=C(Nc1ccccc1)N1CCOc2cc(-c3ccc(C4CCCCC4)cc3)ccc21

nearest known ligand 0.78

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 20/20 0.78
▸ SOAT2 O75908 3/20 0.78
▸ CYP2C9 P11712 1/20 0.55
▸ SOAT1 P35610 1/20 0.55
▸ DGAT2 Q96PD7 1/20 0.55

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
SCHEMBL10262233 0.89 DGAT1 (0.85) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10197338 0.88 DGAT1 (0.87) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL407907 0.88 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10197249 0.88 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL13190495 0.88 DGAT1 (0.62) DGAT1SOAT2SOAT1
SCHEMBL13190400 0.88 DGAT1 (0.83) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL407906 0.88 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10197240 0.88 DGAT1 (1.00) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL10197313 0.87 DGAT1 (0.82) DGAT1SOAT2CYP2C9SOAT1DGAT2
SCHEMBL13190626 0.87 DGAT1 (0.63) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010107768-A1 BICYCLIC COMPOUNDS AS INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2010-09-23 — — WO disclosed
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