SCHEMBL2655663

SCHEMBL2655663

COC[C@@H](CI)Oc1cc(O)cc(C(=O)Nc2cnc(C)cn2)c1

nearest known ligand 0.51

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.51
KCNH2 Q12809 4/20 0.51
RARA P10276 2/20 0.42
RARB P10826 2/20 0.42
RARG P13631 2/20 0.41

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
SCHEMBL2660380 0.87 GCK (0.65) GCKKCNH2RARARARBRARG
SCHEMBL1427153 0.87 GCK (0.65) GCKKCNH2RARARARBRARG
SCHEMBL1427229 0.82 GCK (0.64) GCKKCNH2RARARARB
SCHEMBL4783311 0.82 GCK (0.64) GCKKCNH2RARARARB
SCHEMBL1427361 0.82 GCK (0.51) GCKKCNH2RARARARBRARG
SCHEMBL2654780 0.79 CHRNB2 (0.48) GCKKCNH2
SCHEMBL2662313 0.78 GCK (0.53) GCKKCNH2RARARARBRARG
SCHEMBL1042208 0.78 GCK (0.53) GCKKCNH2RARARARBRARG
SCHEMBL1427125 0.77 GCK (0.51) GCKKCNH2RARARARBRARG
SCHEMBL1653673 0.77 GCK (0.51) GCKKCNH2RARARARBRARG

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1902052-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES AstraZeneca AB (SE) 2008-03-26 EP disclosed
WO-2007007041-A1 HETEROARYL BENZAMIDE DERIVATIVES FOR USE AS GLK ACTIVATORS IN THE TREATMENT OF DIABETES ASTRAZENECA AB (SE) 2007-01-18 WO disclosed