SCHEMBL9954498

SCHEMBL9954498

COc1ncc(Br)cc1-c1cnn(COCC[Si](C)(C)C)n1

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 4/20 0.34

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
SCHEMBL9959889 0.83 DGAT1 (0.35) DGAT1
SCHEMBL9953694 0.81 ALPL (0.34) DGAT1
SCHEMBL3508463 0.76 DGAT1 (0.39) DGAT1
SCHEMBL9952816 0.75 DGAT1 (0.36) DGAT1
SCHEMBL9954569 0.74 DGAT1 (0.35) DGAT1
SCHEMBL9953536 0.73 DGAT1 (0.32) DGAT1
SCHEMBL21259853 0.72 DGAT1 (0.42) DGAT1
SCHEMBL27193468 0.71 DGAT1 (0.37) DGAT1
SCHEMBL23294447 0.70 DGAT1 (0.40) DGAT1
SCHEMBL29851912 0.70 DGAT1 (0.40) 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-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed