SCHEMBL2665279

SCHEMBL2665279

CS(=O)(=O)Nc1cnc(NC(=O)/C(=C/C2CCCC2)c2ccc(S(C)(=O)=O)c(Cl)c2)cn1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCK P35557 13/20 0.48
KCNH2 Q12809 2/20 0.42
S1PR1 P21453 1/20 0.33
TYK2 P29597 1/20 0.33
ABL1 P00519 1/20 0.33
BCR P11274 1/20 0.33
SCN9A Q15858 1/20 0.32

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
SCHEMBL2665304 0.90 GCK (0.46) GCKKCNH2S1PR1TYK2ABL1
SCHEMBL9072608 0.89 GCK (0.46) GCKKCNH2
SCHEMBL9072610 0.89 GCK (0.47) GCKKCNH2TYK2
SCHEMBL9072559 0.88 GCK (0.46) GCKKCNH2
SCHEMBL9072612 0.88 GCK (0.46) GCKKCNH2ABL1
SCHEMBL2665262 0.88 GCK (0.48) GCKKCNH2
SCHEMBL2665329 0.88 GCK (0.46) GCKKCNH2
SCHEMBL2665327 0.88 GCK (0.46) GCKKCNH2TYK2
SCHEMBL2665292 0.88 GCK (0.46) GCKKCNH2SCN9A
SCHEMBL2665280 0.88 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