SCHEMBL9955005

SCHEMBL9955005

COc1ncc(-c2ccc3nc(N)n(-c4ccccc4)c(=O)c3c2)cc1NS(C)(=O)=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 18/20 1.00
PIK3CG P48736 15/20 1.00
PIK3CD O00329 2/20 0.54

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
SCHEMBL9955048 0.90 PI4KA (0.81) PI4KAPIK3CGPIK3CD
SCHEMBL10289361 0.88 PI4KA (0.85) PI4KAPIK3CG
SCHEMBL9953227 0.88 PI4KA (0.90) PI4KAPIK3CGPIK3CD
SCHEMBL9954755 0.88 PI4KA (1.00) PI4KAPIK3CGPIK3CD
SCHEMBL9953042 0.88 PI4KA (1.00) PI4KAPIK3CG
SCHEMBL9959146 0.88 PI4KA (0.88) PI4KAPIK3CG
SCHEMBL9953349 0.88 PI4KA (0.83) PI4KAPIK3CGPIK3CD
SCHEMBL10288663 0.87 PI4KA (1.00) PI4KAPIK3CGPIK3CD
SCHEMBL9955317 0.87 PI4KA (0.89) PI4KAPIK3CGPIK3CD
SCHEMBL10289366 0.87 PI4KA (0.84) PI4KAPIK3CGPIK3CD

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