SCHEMBL2665335

SCHEMBL2665335

C=C(c1cnc(NC(=O)/C(=C/C2CCCC2)c2ccc(S(C)(=O)=O)c(Cl)c2)cn1)C(C)(C)O

nearest known ligand 0.44

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GCK P35557 11/20 0.44
KCNH2 Q12809 2/20 0.39
CYP1A2 P05177 1/20 0.31
ALOX5AP P20292 1/20 0.31

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
SCHEMBL9072610 0.89 GCK (0.47) GCKKCNH2
SCHEMBL2665265 0.89 GCK (0.46) GCKKCNH2
SCHEMBL2665292 0.87 GCK (0.46) GCKKCNH2CYP1A2ALOX5AP
SCHEMBL2665261 0.87 GCK (0.46) GCKKCNH2
SCHEMBL9072612 0.86 GCK (0.46) GCKKCNH2
SCHEMBL2665279 0.85 GCK (0.48) GCKKCNH2
SCHEMBL9072566 0.84 KCNH2 (0.48) GCKKCNH2
SCHEMBL9072559 0.83 GCK (0.46) GCKKCNH2
SCHEMBL2665262 0.83 GCK (0.48) GCKKCNH2
SCHEMBL2665329 0.83 GCK (0.46) 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