SCHEMBL10288669

SCHEMBL10288669

CCCn1cc(-c2cc(-c3ccc4nc(N)n(-c5ccccc5)c(=O)c4c3)cnc2OC)cn1

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 20/20 0.60
PIK3CG P48736 17/20 0.60
PIK3CD O00329 1/20 0.41
PIP5K1C O60331 1/20 0.41
PIK3CA P42336 1/20 0.41
PIK3CB P42338 1/20 0.41
PI4KB Q9UBF8 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
SCHEMBL10289042 0.82 PI4KA (0.64) PI4KAPIK3CG
SCHEMBL9953522 0.81 PI4KA (0.73) PI4KAPIK3CG
SCHEMBL9954698 0.80 PI4KA (0.72) PI4KAPIK3CGPIK3CA
SCHEMBL9953014 0.80 PI4KA (0.61) PI4KAPIK3CG
SCHEMBL10289357 0.80 PI4KA (0.61) PI4KAPIK3CG
SCHEMBL9955175 0.80 PI4KA (0.61) PI4KAPIK3CG
SCHEMBL9953082 0.79 PI4KA (0.70) PI4KAPIK3CGPIK3CD
SCHEMBL9954029 0.79 PI4KA (0.61) PI4KAPIK3CGPIK3CA
SCHEMBL10289146 0.79 PI4KA (0.67) PI4KAPIK3CG
SCHEMBL9953627 0.79 PI4KA (0.62) 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