SCHEMBL2669552

SCHEMBL2669552

CN(C)C(=O)c1cnc(Oc2cc(OC3CCN(C)C3=O)cc(C(N)=O)c2)cn1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GCK P35557 15/20 0.49
HRH3 Q9Y5N1 2/20 0.35
HRH1 P35367 1/20 0.35
SCN9A Q15858 2/20 0.33
PARP1 P09874 1/20 0.32

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
SCHEMBL2669545 1.00 GCK (0.49) GCKHRH3HRH1SCN9APARP1
SCHEMBL2075157 0.92 GCK (0.49) GCKHRH3HRH1SCN9A
SCHEMBL2074279 0.90 GCK (0.48) GCKHRH3HRH1SCN9A
SCHEMBL2657797 0.90 GCK (0.48) GCKHRH3HRH1SCN9A
SCHEMBL2074639 0.84 GCK (0.56) GCK
SCHEMBL2659316 0.84 GCK (0.56) GCK
SCHEMBL9987945 0.82 GCK (0.48) GCKHRH3HRH1SCN9A
SCHEMBL2075590 0.81 GCK (0.43) GCKHRH3HRH1
SCHEMBL2074572 0.81 GRM5 (0.43) GCK
SCHEMBL9987186 0.81 GCK (0.75) GCKHRH3HRH1SCN9A

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-2008050101-A2 BENZOYL AMINO HETEROCYCLYL COMPOUNDS USEFUL IN THE TREATMENT OF A DISEASE MEDIATED THROUGH GLK ASTRAZENECA AB (SE) 2008-05-02 WO disclosed