SCHEMBL2669663

SCHEMBL2669663

C/C=C(/OC(CC)CO)c1ccc(-c2cc(Oc3ccc(S(C)(=O)=O)nc3)cc(O[C@@H](C)COC)c2)[nH]1

nearest known ligand 0.39

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.39
KCNH2 Q12809 3/20 0.36

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
SCHEMBL2669600 0.95 GCK (0.42) GCKKCNH2
SCHEMBL2669587 0.93 GCK (0.40) GCKKCNH2
SCHEMBL2669687 0.89 GCK (0.43) GCKKCNH2
SCHEMBL12279501 0.88 GCK (0.35) GCKKCNH2
SCHEMBL423316 0.85 GCK (0.47) GCKKCNH2
SCHEMBL2669770 0.83 GCK (0.38) GCK
SCHEMBL428723 0.83 GCK (0.43) GCKKCNH2
SCHEMBL12265454 0.82 GCK (0.35) GCK
SCHEMBL426318 0.82 GCK (0.44) GCKKCNH2
SCHEMBL9071144 0.81 GCK (0.45) 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-2009099080-A1 NOVEL PHENYLPYRROLE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-08-13 WO disclosed