SCHEMBL9953322

SCHEMBL9953322

COc1ncc(-c2ccc3nc(N)n(-c4ccccc4)c(=O)c3c2)cc1S(=O)(=O)N1Cc2ccccc2C1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 20/20 0.70
PIK3CG P48736 17/20 0.70

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
SCHEMBL9959031 0.91 PI4KA (0.65) PI4KAPIK3CG
SCHEMBL9953613 0.90 PI4KA (0.67) PI4KAPIK3CG
SCHEMBL9953192 0.88 PI4KA (0.77) PI4KAPIK3CG
SCHEMBL9954833 0.88 PI4KA (0.64) PI4KAPIK3CG
SCHEMBL9954117 0.87 PI4KA (0.73) PI4KAPIK3CG
SCHEMBL9954173 0.87 PI4KA (0.61) PI4KAPIK3CG
SCHEMBL9953545 0.87 PI4KA (0.76) PI4KAPIK3CG
SCHEMBL9954413 0.86 PI4KA (0.68) PI4KAPIK3CG
SCHEMBL10289048 0.86 PI4KA (0.73) PI4KAPIK3CG
SCHEMBL10289352 0.85 PI4KA (0.67) 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