SCHEMBL2657403

SCHEMBL2657403

Cc1cnc(NC(=O)c2cc(O)cc(O[C@@]3(C)CCNC3=O)c2)cn1

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GCK P35557 19/20 0.40
KCNH2 Q12809 5/20 0.40
HPGDS O60760 1/20 0.36

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
SCHEMBL2658151 0.85 GCK (0.52) GCKKCNH2
SCHEMBL2658074 0.82 GCK (0.53) GCKKCNH2
SCHEMBL2659314 0.81 GCK (0.55) GCKKCNH2
SCHEMBL2656839 0.80 GCK (0.55) GCKKCNH2
SCHEMBL2657535 0.78 GCK (0.48) GCKKCNH2
SCHEMBL2656378 0.78 CA12 (0.46) HPGDS
SCHEMBL2658396 0.78 CA12 (0.46) HPGDS
SCHEMBL2655335 0.75 GCK (0.44) GCKKCNH2
SCHEMBL1427361 0.75 GCK (0.51) GCKKCNH2
SCHEMBL2654780 0.74 CHRNB2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2086964-A2 BENZOYL AMINO HETEROCYCLYL COMPOUNDS USEFUL IN THE TREATMENT OF A DISEASE MEDIATED THROUGH GLK Astra Zeneca AB (SE) 2009-08-12 EP disclosed
WO-2008050101-A2 BENZOYL AMINO HETEROCYCLYL COMPOUNDS USEFUL IN THE TREATMENT OF A DISEASE MEDIATED THROUGH GLK ASTRAZENECA AB (SE) 2008-05-02 WO disclosed