SCHEMBL10288698

SCHEMBL10288698

CS(=O)(=O)NC(=O)c1cncc(-c2ccc3nc(N)n(-c4ccccc4)c(=O)c3c2)c1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 16/20 0.59
PIK3CG P48736 13/20 0.59
XDH P47989 1/20 0.39
KAT6A Q92794 1/20 0.39
CDK7 P50613 1/20 0.38
PTGS1 P23219 1/20 0.38
PTGS2 P35354 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
SCHEMBL10289377 0.87 PI4KA (0.49) PI4KAPIK3CG
SCHEMBL9959815 0.86 XDH (0.56) PI4KAPIK3CGXDH
SCHEMBL9954015 0.86 PI4KA (0.51) PI4KAPIK3CGXDH
SCHEMBL9954515 0.85 PI4KA (0.57) PI4KAPIK3CG
SCHEMBL9953679 0.85 PI4KA (0.51) PI4KAPIK3CG
SCHEMBL10289054 0.83 PI4KA (0.51) PI4KAPIK3CGXDH
SCHEMBL9953943 0.82 PI4KA (0.59) PI4KAPIK3CG
SCHEMBL10289075 0.81 PI4KA (0.77) PI4KAPIK3CG
SCHEMBL9954428 0.79 PI4KA (0.56) PI4KAPIK3CG
SCHEMBL9954693 0.78 PIM1 (0.46) PI4KAPIK3CG

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-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed