SCHEMBL9954675

SCHEMBL9954675

Nc1ncc(-c2ccc3nc(N)n(-c4ccccc4)c(=O)c3c2)cc1S(=O)(=O)NC1CC1

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 19/20 0.61
PIK3CG P48736 16/20 0.55
ALOX5AP P20292 1/20 0.40
FEN1 P39748 1/20 0.40

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
SCHEMBL14247707 0.89 PI4KA (0.47) PI4KAPIK3CGALOX5APFEN1
SCHEMBL9954290 0.89 PI4KA (0.71) PI4KAPIK3CG
SCHEMBL9954511 0.87 PI4KA (0.64) PI4KAPIK3CG
SCHEMBL9960507 0.87 PI4KA (0.54) PI4KAPIK3CG
SCHEMBL9954271 0.86 PI4KA (0.68) PI4KAPIK3CG
SCHEMBL9954408 0.86 PI4KA (0.69) PI4KAPIK3CG
SCHEMBL9954715 0.86 PI4KA (0.69) PI4KAPIK3CG
SCHEMBL9952892 0.85 PI4KA (0.68) PI4KAPIK3CG
SCHEMBL9953643 0.84 PI4KA (0.55) PI4KAPIK3CG
SCHEMBL9954587 0.84 PI4KA (0.61) 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 2 patents. 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
WO-2012087938-A1 QUINAZOLINONE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-06-28 WO disclosed