SCHEMBL16627460

SCHEMBL16627460

C[C@H](n1ccc2cc(N3CCOc4ncnc(N)c4C3=O)ccc21)C(C)(C)O

nearest known ligand 0.71

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.71

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
SCHEMBL16627487 0.90 DGAT1 (0.60) DGAT1
SCHEMBL15522231 0.90 DGAT1 (0.74) DGAT1
SCHEMBL14062103 0.85 DGAT1 (0.69) DGAT1
SCHEMBL15733205 0.83 DGAT1 (1.00) DGAT1
SCHEMBL15522130 0.82 DGAT1 (0.77) DGAT1
SCHEMBL19481437 0.81 DGAT1 (0.86) DGAT1
SCHEMBL17238977 0.80 DGAT1 (0.77) DGAT1
SCHEMBL17921242 0.79 DGAT1 (0.83) DGAT1
SCHEMBL14061822 0.79 DGAT1 (0.72) DGAT1
SCHEMBL17921250 0.79 DGAT1 (0.74) 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-2015049668-A1 NOVEL COMPOUND AS A DIACYLGLYCEROL ACYLTRANSFERASE INHIBITOR GLAXOSMITHKLINE INTELLECTUAL PROPERTY (NO.2) LIMITED (GB) 2015-04-09 WO disclosed