SCHEMBL17551967

SCHEMBL17551967

COC1(CC(=O)O)CCc2cc(-c3ccc(-c4cccc(C(F)(F)F)c4)cc3)ccc2C1=O

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 19/20 0.59
▸ PARP10 Q53GL7 1/20 0.47
▸ PARP11 Q9NR21 1/20 0.47

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
SCHEMBL14061863 0.89 DGAT1 (0.77) DGAT1
SCHEMBL14137111 0.89 DGAT1 (0.77) DGAT1
SCHEMBL17552048 0.85 DGAT1 (0.65) DGAT1
SCHEMBL14060357 0.79 DGAT1 (0.73) DGAT1
SCHEMBL14061930 0.79 DGAT1 (0.48) DGAT1
SCHEMBL14137105 0.79 DGAT1 (0.69) DGAT1
SCHEMBL17211838 0.77 DGAT1 (0.77) DGAT1
SCHEMBL17200623 0.76 DGAT1 (0.76) DGAT1
SCHEMBL14059735 0.76 DGAT1 (0.76) DGAT1
SCHEMBL14060362 0.76 DGAT1 (0.72) 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
EP-2723332-B1 NOVEL COMPOUNDS AS DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS GLAXOSMITHKLINE IP NO 2 LTD (GB) 2016-03-02 — — EP disclosed
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