SCHEMBL9953530

SCHEMBL9953530

COc1ncc(-c2ccc3nc(N)n(-c4ccccc4)c(=O)c3c2)cc1C(=O)Nc1ccccc1

nearest known ligand 0.68

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 19/20 0.68
PIK3CG P48736 16/20 0.68
ALK Q9UM73 1/20 0.41

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
SCHEMBL10289348 0.94 PI4KA (0.66) PI4KAPIK3CG
SCHEMBL10288880 0.93 PI4KA (0.64) PI4KAPIK3CG
SCHEMBL9954007 0.90 PI4KA (0.71) PI4KAPIK3CG
SCHEMBL9955594 0.90 PI4KA (0.71) PI4KAPIK3CG
SCHEMBL10288656 0.90 PI4KA (0.55) PI4KAPIK3CGALK
SCHEMBL10289358 0.89 PI4KA (0.70) PI4KAPIK3CG
SCHEMBL9953916 0.89 PI4KA (0.70) PI4KAPIK3CG
Lithium SCHEMBL9953931 0.89 PI4KA (0.70) PI4KAPIK3CG
SCHEMBL10289151 0.89 PI4KA (0.67) PI4KAPIK3CG
SCHEMBL9954745 0.88 PI4KA (0.56) 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