SCHEMBL9070816

SCHEMBL9070816

COC[C@@H](C)Oc1cc(C(=O)Nc2ccn(C)n2)cc(Oc2ccc(C(=O)N3CCOCC3)cn2)n1

nearest known ligand 0.58

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.58
KCNH2 Q12809 4/20 0.58

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
SCHEMBL2667355 0.93 GCK (0.65) GCKKCNH2
SCHEMBL2667780 0.90 GCK (0.69) GCKKCNH2
SCHEMBL2667345 0.89 GCK (0.58) GCKKCNH2
SCHEMBL2667347 0.85 GCK (0.54) GCKKCNH2
SCHEMBL9070815 0.84 GCK (0.51) GCKKCNH2
SCHEMBL9070905 0.84 GCK (0.64) GCKKCNH2
SCHEMBL9070812 0.83 GCK (0.54) GCKKCNH2
SCHEMBL2667973 0.83 GCK (0.77) GCKKCNH2
SCHEMBL1377005 0.83 GCK (0.81) GCKKCNH2
SCHEMBL2667788 0.82 GCK (0.71) 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-2009083553-A1 AZINE COMPOUNDS AS GLUCOKINASE ACTIVATORS RHEOSCIENCE A/S (DK) 2009-07-09 WO disclosed