SCHEMBL2669266

SCHEMBL2669266

NC(=O)C(CC1CCCCC1)n1c(=O)[nH]c2ncccc2c1=O

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 14/20 0.54
▸ FEN1 P39748 1/20 0.45
▸ ALDH1A1 P00352 1/20 0.38
▸ MTOR P42345 1/20 0.38
▸ OPRL1 P41146 2/20 0.37
▸ OPRM1 P35372 1/20 0.37
▸ OPRK1 P41145 1/20 0.37

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
SCHEMBL12228084 0.82 GCK (0.81) GCK
SCHEMBL2514499 0.75 GCK (0.73) GCKALDH1A1
SCHEMBL17335956 0.73 GCK (0.52) GCKFEN1ALDH1A1
SCHEMBL2514393 0.71 GCK (1.00) GCK
SCHEMBL11871647 0.70 FEN1 (0.55) FEN1ALDH1A1MTOROPRL1OPRM1
SCHEMBL2669078 0.69 GCK (0.73) GCK
SCHEMBL9072908 0.69 GCK (0.64) GCKALDH1A1
SCHEMBL9072911 0.69 GCK (0.73) GCKFEN1ALDH1A1
SCHEMBL11865926 0.69 FEN1 (0.60) FEN1ALDH1A1
SCHEMBL12228041 0.69 GCK (0.65) GCK

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-2007104034-A2 GLUCOKINASE ACTIVATORS TAKEDA SAN DIEGO, INC. (US) 2007-09-13 — — WO disclosed
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