SCHEMBL9952675

SCHEMBL9952675

Nc1nc2ccc(-c3ccc(NC(=O)Nc4cccnc4)nc3)cc2c(=O)n1-c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 12/20 0.53
PIK3CG P48736 9/20 0.53
TSHR P16473 1/20 0.46
MCL1 Q07820 5/20 0.45
DGAT1 O75907 1/20 0.42

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
SCHEMBL9954563 0.93 PI4KA (0.51) PI4KAPIK3CGDGAT1
SCHEMBL9955414 0.91 PI4KA (0.49) PI4KAPIK3CGDGAT1
SCHEMBL10289348 0.81 PI4KA (0.66) PI4KAPIK3CGMCL1
SCHEMBL9954130 0.77 PI4KA (0.62) PI4KAPIK3CG
SCHEMBL9954462 0.76 PI4KA (0.56) PI4KAPIK3CG
SCHEMBL9954745 0.75 PI4KA (0.56) PI4KAPIK3CGMCL1
SCHEMBL9953530 0.74 PI4KA (0.68) PI4KAPIK3CG
SCHEMBL10289142 0.74 PI4KA (0.74) PI4KAPIK3CG
SCHEMBL10288880 0.73 PI4KA (0.64) PI4KAPIK3CGMCL1
SCHEMBL9954652 0.72 PI4KA (0.76) 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