SCHEMBL9986210

SCHEMBL9986210

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

nearest known ligand 0.76

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GCK P35557 15/20 0.76
PTGS2 P35354 3/20 0.36
PTGS1 P23219 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
SCHEMBL9987116 0.86 GCK (1.00) GCK
SCHEMBL9986965 0.79 GCK (0.82) GCK
SCHEMBL9986665 0.79 GCK (0.85) GCKPTGS2
SCHEMBL9987128 0.79 GCK (0.81) GCK
SCHEMBL9987239 0.78 GCK (0.84) GCK
SCHEMBL9987029 0.76 GCK (0.79) GCK
SCHEMBL9988133 0.76 GCK (0.72) GCK
SCHEMBL9988134 0.76 GCK (0.72) GCK
SCHEMBL9986994 0.74 GCK (1.00) GCK
SCHEMBL9986909 0.74 GCK (1.00) GCK

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 3 patents. 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 claimed
WO-2011158149-A1 2-(3,5-DISUBSTITUTEDPHENYL)PYRIMIDIN-4(3H)-ONE DERIVATIVES PFIZER INC. (US) 2011-12-22 WO disclosed
WO-2011158149-A1 2-(3,5-DISUBSTITUTEDPHENYL)PYRIMIDIN-4(3H)-ONE DERIVATIVES PFIZER INC. (US) 2011-12-22 WO disclosed