SCHEMBL2665294

SCHEMBL2665294

CSCc1cnc(NC(=O)/C(=C/C2CCCC2)c2ccc(S(C)(=O)=O)c(Cl)c2)cn1

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCK P35557 16/20 0.46
KCNH2 Q12809 2/20 0.41
CA12 O43570 1/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
CA6 P23280 1/20 0.30
CA7 P43166 1/20 0.30
CA13 Q8N1Q1 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
SCHEMBL2665262 0.91 GCK (0.48) GCKKCNH2
SCHEMBL2665280 0.90 GCK (0.47) GCKKCNH2
SCHEMBL9072573 0.89 GCK (0.47) GCKKCNH2
SCHEMBL9072556 0.88 GCK (0.46) GCKKCNH2
SCHEMBL2665296 0.88 GCK (0.48) GCKKCNH2
SCHEMBL2665323 0.88 GCK (0.46) GCKKCNH2
SCHEMBL9072559 0.87 GCK (0.46) GCKKCNH2
SCHEMBL9072614 0.87 GCK (0.45) GCKKCNH2
SCHEMBL2665306 0.87 GCK (0.45) GCKKCNH2
SCHEMBL2665275 0.86 GCK (0.47) GCKKCNH2

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
US-7132425-B2 5-substituted-six-membered heteroaromatic glucokinase activators HOFFMANN-LA ROCHE INC. (US) 2006-11-07 US disclosed