SCHEMBL20428663

SCHEMBL20428663

COC(=O)C(C)(C)COc1ccc(-c2ccc(-c3ncc(-c4ccc(OC)cc4)[nH]3)cc2)cn1

nearest known ligand 0.83

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ DGAT1 O75907 19/20 0.83
▸ SCN2A Q99250 1/20 0.51

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
SCHEMBL20428644 0.91 DGAT1 (0.82) DGAT1SCN2A
SCHEMBL16649188 0.91 DGAT1 (1.00) DGAT1SCN2A
SCHEMBL16661232 0.82 DGAT1 (1.00) DGAT1
SCHEMBL16649144 0.81 DGAT1 (1.00) DGAT1
SCHEMBL16787582 0.79 DGAT1 (0.84) DGAT1
SCHEMBL16648977 0.79 DGAT1 (1.00) DGAT1
SCHEMBL16787615 0.78 DGAT1 (0.74) DGAT1
SCHEMBL16660848 0.78 DGAT1 (0.85) DGAT1
SCHEMBL20428655 0.77 DGAT1 (0.61) DGAT1
SCHEMBL16660918 0.77 DGAT1 (0.75) 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
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