SCHEMBL2667348

SCHEMBL2667348

COC[C@@H](C)Oc1cc(C(=O)Nc2nc(C)cs2)cc(Oc2ccc(C(=O)N3CCCC3)cn2)n1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCK P35557 17/20 0.59
KCNH2 Q12809 4/20 0.50
GRM5 P41594 2/20 0.47
ALDH1A1 P00352 1/20 0.43
MAPK1 P28482 1/20 0.43
KMT2A Q03164 1/20 0.43

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
SCHEMBL9070812 0.93 GCK (0.54) GCKKCNH2GRM5ALDH1A1MAPK1
SCHEMBL9070969 0.90 GCK (0.54) GCKKCNH2
SCHEMBL9070967 0.89 GCK (0.52) GCKKCNH2ALDH1A1MAPK1KMT2A
SCHEMBL2667346 0.89 GCK (0.56) GCKKCNH2
SCHEMBL9070966 0.86 GRM5 (0.50) GCKGRM5
SCHEMBL9071018 0.85 GCK (0.49) GCKKCNH2
SCHEMBL9070965 0.85 GCK (0.65) GCKKCNH2
SCHEMBL2667784 0.84 GCK (0.51) GCKKCNH2GRM5
SCHEMBL9070839 0.84 POLB (0.47) GCKGRM5ALDH1A1MAPK1
SCHEMBL2667351 0.84 GCK (0.48) GCKKCNH2ALDH1A1MAPK1

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