SCHEMBL2668836

SCHEMBL2668836

CCOP(=O)(Cc1ccc(NC(=O)c2cc(OCCO)cc(Oc3ccc(S(C)(=O)=O)cc3)c2)nc1)OCC

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 20/20 0.61
▸ KCNH2 Q12809 3/20 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
SCHEMBL10203633 0.88 GCK (0.69) GCKKCNH2
SCHEMBL1140968 0.87 GCK (0.81) GCKKCNH2
SCHEMBL16473218 0.82 GCK (0.81) GCKKCNH2
SCHEMBL16473166 0.81 GCK (0.76) GCKKCNH2
SCHEMBL1132358 0.78 GCK (0.73) GCKKCNH2
SCHEMBL12021036 0.77 GCK (0.84) GCKKCNH2
SCHEMBL1107470 0.77 GCK (0.86) GCKKCNH2
SCHEMBL16473167 0.76 GCK (0.66) GCKKCNH2
SCHEMBL1107463 0.76 GCK (0.87) GCKKCNH2
SCHEMBL1107337 0.76 GCK (0.60) 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
WO-2008005964-A2 PHOSPHONATE AND PHOSPHINATE COMPOUNDS AS GLUCOKINASE ACTIVATORS BRISTOL-MYERS SQUIBB COMPANY (US) 2008-01-10 — — WO disclosed
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