SCHEMBL2669766

SCHEMBL2669766

COC[C@H](C)Oc1cc(Oc2cnc(S(C)(=O)=O)cn2)cc(-c2ccc(C3=NCC(CO)O3)[nH]2)c1

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.43
KCNH2 Q12809 2/20 0.33

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
SCHEMBL422973 1.00 GCK (0.43) GCKKCNH2
SCHEMBL422749 0.94 GCK (0.42) GCKKCNH2
SCHEMBL422177 0.93 GCK (0.41) GCK
SCHEMBL422757 0.93 GCK (0.42) GCKKCNH2
SCHEMBL9071185 0.91 GCK (0.44) GCKKCNH2
SCHEMBL427938 0.91 GCK (0.44) GCKKCNH2
SCHEMBL421886 0.91 GCK (0.39) GCKKCNH2
SCHEMBL425620 0.90 GCK (0.41) GCKKCNH2
SCHEMBL424630 0.89 GCK (0.40) GCK
SCHEMBL422476 0.87 GCK (0.42) 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