SCHEMBL13190495

SCHEMBL13190495

O=C(Nc1ccc(C(F)(F)F)cc1)N1CCOc2cc(-c3ccc(C4CCCCC4)cc3)ccc21

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 20/20 0.62
▸ SOAT2 O75908 2/20 0.62
▸ SOAT1 P35610 1/20 0.56

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
SCHEMBL410970 0.88 DGAT1 (0.81) DGAT1SOAT2SOAT1
SCHEMBL410969 0.88 DGAT1 (0.81) DGAT1SOAT2SOAT1
SCHEMBL13190286 0.88 DGAT1 (0.78) DGAT1SOAT2SOAT1
SCHEMBL13190274 0.84 DGAT1 (0.60) DGAT1
SCHEMBL10259027 0.82 DGAT1 (0.80) DGAT1SOAT2SOAT1
SCHEMBL406946 0.82 DGAT1 (0.80) DGAT1SOAT2SOAT1
SCHEMBL406947 0.82 DGAT1 (0.80) DGAT1SOAT2SOAT1
SCHEMBL13190157 0.81 DGAT1 (0.61) DGAT1SOAT2SOAT1
SCHEMBL13190161 0.81 DGAT1 (0.65) DGAT1SOAT2SOAT1
SCHEMBL13190498 0.80 DGAT1 (0.62) 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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