SCHEMBL20428782

SCHEMBL20428782

CC(C)Oc1nc(-c2ccc(Br)cc2Cl)nn1COCCCCS(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
DGAT1 O75907 2/20 0.41
CRHR1 P34998 1/20 0.30
DPP4 P27487 1/20 0.30
DPP7 Q9UHL4 1/20 0.30

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
SCHEMBL21064883 0.93 DGAT1 (0.42) DGAT1CRHR1DPP4DPP7
SCHEMBL16661248 0.84 DGAT1 (0.56) DGAT1CRHR1DPP4DPP7
SCHEMBL20428828 0.84 DGAT1 (0.31) DGAT1
SCHEMBL21064879 0.82 DGAT1 (0.55) DGAT1
SCHEMBL16661257 0.75 DGAT1 (0.38) DGAT1CRHR1
SCHEMBL18552911 0.75 DGAT1 (0.38) DGAT1CRHR1DPP4DPP7
SCHEMBL16661005 0.73 DGAT1 (0.72) DGAT1
SCHEMBL16661275 0.70 PDE10A (0.34) DGAT1
SCHEMBL16661043 0.69 DGAT1 (0.49) DGAT1CRHR1DPP4DPP7
SCHEMBL16661247 0.68 DGAT1 (0.36) DGAT1CRHR1

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