SCHEMBL13356306

SCHEMBL13356306

COC(=O)CC1CCC2(CC1)CCN(c1ccc(NC(=O)c3oc(N4CCCC(C)C4)nc3C(F)(F)F)cn1)CC2

nearest known ligand 0.69

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.69

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
SCHEMBL12313690 0.90 DGAT1 (0.55) DGAT1
SCHEMBL12314810 0.83 DGAT1 (0.77) DGAT1
SCHEMBL2393689 0.83 DGAT1 (0.70) DGAT1
SCHEMBL2145144 0.83 DGAT1 (0.76) DGAT1
SCHEMBL2408683 0.83 DGAT1 (0.69) DGAT1
SCHEMBL2145922 0.82 DGAT1 (0.58) DGAT1
SCHEMBL2145925 0.82 DGAT1 (0.58) DGAT1
SCHEMBL2395396 0.82 DGAT1 (0.70) DGAT1
SCHEMBL2145571 0.82 DGAT1 (1.00) DGAT1
SCHEMBL2393743 0.81 DGAT1 (0.79) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8716312-B2 Inhibitors of diacylglycerol acyltransferase MERCK SHARP & DOHME CORPORATION (US) 2014-05-06 US disclosed
WO-2010059602-A2 INHIBITORS OF DIACYLGLYCEROL ACYLTRANSFERASE SCHERING CORPORATION (US) 2010-05-27 WO disclosed