SCHEMBL9953679

SCHEMBL9953679

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

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 13/20 0.51
PIK3CG P48736 10/20 0.51
MKNK1 Q9BUB5 3/20 0.45
MKNK2 Q9HBH9 3/20 0.45
CYP11B2 P19099 2/20 0.44
CYP11B1 P15538 1/20 0.44
HCAR1 Q9BXC0 1/20 0.39
TGM2 P21980 1/20 0.39

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
SCHEMBL9954515 0.88 PI4KA (0.57) PI4KAPIK3CGCYP11B2CYP11B1
SCHEMBL9954015 0.86 PI4KA (0.51) PI4KAPIK3CG
SCHEMBL9959815 0.86 XDH (0.56) PI4KAPIK3CG
SCHEMBL10288698 0.85 PI4KA (0.59) PI4KAPIK3CG
SCHEMBL9954693 0.83 PIM1 (0.46) PI4KAPIK3CGCYP11B2
SCHEMBL10289054 0.83 PI4KA (0.51) PI4KAPIK3CG
SCHEMBL9954049 0.83 PI4KA (0.53) PI4KAPIK3CGHCAR1
SCHEMBL10288780 0.83 PI4KA (0.52) PI4KAPIK3CGHCAR1TGM2
SCHEMBL10289377 0.82 PI4KA (0.49) PI4KAPIK3CG
SCHEMBL9955619 0.80 PI4KA (0.56) PI4KAPIK3CGCYP11B2CYP11B1

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