SCHEMBL20428790

SCHEMBL20428790

CCCOCn1nc(-c2ccc(-c3cnc(OCC(C)(C)C(=O)OC)cc3C)cn2)nc1OCC(F)(F)C(F)(F)F

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 20/20 0.65

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
SCHEMBL20428736 0.93 DGAT1 (0.63) DGAT1
SCHEMBL16661061 0.93 DGAT1 (0.76) DGAT1
SCHEMBL16661354 0.92 DGAT1 (0.62) DGAT1
SCHEMBL16661069 0.88 DGAT1 (0.77) DGAT1
SCHEMBL16661273 0.87 DGAT1 (0.67) DGAT1
SCHEMBL16661212 0.86 DGAT1 (0.54) DGAT1
SCHEMBL16661041 0.86 DGAT1 (0.75) DGAT1
SCHEMBL16661215 0.81 DGAT1 (0.68) DGAT1
SCHEMBL21064777 0.81 DGAT1 (0.55) DGAT1
SCHEMBL16661021 0.81 DGAT1 (0.57) 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-2862856-B1 IMIDAZOLE AND TRIAZOLE COMPOUNDS AS DGAT-1 INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2018-08-01 EP disclosed