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Sugi Predict / Compounds / SCHEMBL2669690

SCHEMBL2669690

SCHEMBL2669690

COCC(C)Oc1cc(Oc2ccc(S(C)(=O)=O)nc2)cc(-c2ccc(C3=N[C@H](C)[C@H](CO)O3)[nH]2)c1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GCK P35557 20/20 0.41
▸ KCNH2 Q12809 3/20 0.38

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
SCHEMBL422951 1.00 GCK (0.41) GCKKCNH2
SCHEMBL1050580 0.94 GCK (0.42) GCKKCNH2
SCHEMBL423073 0.91 GCK (0.40) GCKKCNH2
SCHEMBL420624 0.90 GCK (0.40) GCKKCNH2
SCHEMBL463308 0.90 GCK (0.37) GCKKCNH2
SCHEMBL463309 0.90 GCK (0.37) GCKKCNH2
SCHEMBL425620 0.86 GCK (0.41) GCKKCNH2
SCHEMBL426075 0.86 GCK (0.43) GCKKCNH2
SCHEMBL424978 0.86 GCK (0.40) GCKKCNH2
SCHEMBL423254 0.85 GCK (0.41) 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