SCHEMBL3636503

SCHEMBL3636503

O=C(Nc1ccc(N2CCN(C(=O)O)CC2)nc1)c1nc(-c2ccccc2)oc1C(F)(F)F

nearest known ligand 0.84

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.84

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
Propionamide SCHEMBL28785439 0.93 DGAT1 (0.79) DGAT1
SCHEMBL596611 0.93 DGAT1 (0.84) DGAT1
SCHEMBL2441519 0.92 DGAT1 (0.86) DGAT1
SCHEMBL594657 0.91 DGAT1 (0.81) DGAT1
SCHEMBL596431 0.91 DGAT1 (1.00) DGAT1
SCHEMBL595256 0.91 DGAT1 (1.00) DGAT1
SCHEMBL596109 0.91 DGAT1 (0.80) DGAT1
SCHEMBL594662 0.91 DGAT1 (0.80) DGAT1
SCHEMBL595795 0.91 DGAT1 (0.82) DGAT1
SCHEMBL2515004 0.90 DGAT1 (0.80) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101835757-B Diacylglycerol acyltransferase inhibitors HOFFMANN LA ROCHE 2014-03-05 CN disclosed
CN-101835757-A Diacylglycerol acyltransferase inhibitors HOFFMANN LA ROCHE 2010-09-15 CN disclosed
EP-2155687-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS Via Pharmaceuticals, Inc. (US) 2010-02-24 EP disclosed
WO-2008141976-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS VIA PHARMACEUTICALS, INC. (US) 2008-11-27 WO disclosed