SCHEMBL15711541

SCHEMBL15711541

O=C(O)CC1(CC(F)(F)F)CCc2cc(-c3cnc(Nc4ccc(I)nc4)s3)ccc2C1=O

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 20/20 0.57

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
SCHEMBL17195461 0.91 DGAT1 (0.57) DGAT1
SCHEMBL15690339 0.91 DGAT1 (0.57) DGAT1
SCHEMBL15711534 0.85 DGAT1 (0.58) DGAT1
SCHEMBL15711532 0.78 DGAT1 (0.65) DGAT1
SCHEMBL15690178 0.78 DGAT1 (0.62) DGAT1
SCHEMBL15689267 0.78 DGAT1 (0.62) DGAT1
SCHEMBL17195440 0.78 DGAT1 (0.62) DGAT1
SCHEMBL15711535 0.77 DGAT1 (0.48) DGAT1
SCHEMBL15689345 0.77 DGAT1 (0.75) DGAT1
SCHEMBL15690395 0.76 DGAT1 (0.68) 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-2014074761-A2 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE LLC (US) 2014-05-15 — — WO disclosed
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