SCHEMBL9988134

SCHEMBL9988134

CCc1cnc(-c2cc(Oc3ccc(S(C)(=O)=O)cc3)cc(OC(C)COCc3ccccc3)c2)[nH]c1=O

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GCK P35557 20/20 0.72
KCNH2 Q12809 1/20 0.38

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
SCHEMBL9988133 1.00 GCK (0.72) GCKKCNH2
SCHEMBL9986965 0.85 GCK (0.82) GCK
SCHEMBL9987116 0.84 GCK (1.00) GCK
SCHEMBL12070254 0.80 GCK (0.44) GCKKCNH2
SCHEMBL9987239 0.79 GCK (0.84) GCK
SCHEMBL9986881 0.78 GCK (0.79) GCKKCNH2
SCHEMBL9986882 0.78 GCK (0.79) GCKKCNH2
SCHEMBL9986665 0.78 GCK (0.85) GCK
SCHEMBL9987128 0.77 GCK (0.81) GCK
SCHEMBL3595253 0.76 GCK (0.45) 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-2011158149-A1 2-(3,5-DISUBSTITUTEDPHENYL)PYRIMIDIN-4(3H)-ONE DERIVATIVES PFIZER INC. (US) 2011-12-22 WO disclosed