SCHEMBL2667970

SCHEMBL2667970

COC[C@@H](C)Oc1cc(C(=O)NC(=N)S)cc(Oc2ccc(C(=O)N3CCCC3)cc2)n1

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.51
KCNH2 Q12809 4/20 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
SCHEMBL9071057 0.98 GCK (0.53) GCKKCNH2
SCHEMBL2667693 0.89 GCK (0.47) GCKKCNH2
SCHEMBL2667997 0.87 GCK (0.49) GCKKCNH2
SCHEMBL9071022 0.86 GCK (0.48) GCKKCNH2
SCHEMBL2667646 0.86 GCK (0.46) GCKKCNH2
SCHEMBL9070937 0.84 GCK (0.47) GCKKCNH2
SCHEMBL9071015 0.83 GCK (0.50) GCKKCNH2
SCHEMBL2667630 0.82 GCK (0.51) GCKKCNH2
SCHEMBL2667973 0.82 GCK (0.77) GCKKCNH2
SCHEMBL9070952 0.81 MDM2 (0.48) 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