SCHEMBL790765

SCHEMBL790765

COc1ncc(-c2ccc3nc(N)c(-c4ccc(C(=O)N5CCOCC5)c(O)c4OC)cc3c2)cc1NS(=O)(=O)c1ccc(F)cc1F

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 12/20 0.74
PI4KA P42356 8/20 0.74
PIK3CA P42336 12/20 0.57
MTOR P42345 4/20 0.57
PIK3R1 P27986 5/20 0.57
PIK3CD O00329 4/20 0.57
PIK3CB P42338 4/20 0.57

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
SCHEMBL807175 0.90 PIK3CG (0.76) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL10277220 0.90 PIK3CG (0.78) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL807137 0.89 PIK3CG (0.75) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL807153 0.89 PIK3CG (0.75) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL791064 0.89 PIK3CG (0.81) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL806968 0.89 PIK3CG (0.72) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL807320 0.89 PIK3CG (0.72) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL10277754 0.88 PIK3CG (0.71) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL807085 0.85 PIK3CG (1.00) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL806759 0.85 PIK3CG (0.88) PIK3CGPI4KAPIK3CAMTORPIK3R1

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-2012037108-A1 AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-03-22 WO disclosed
WO-2012037108-A1 AMINOQUINOLINE DERIVATIVES AS ANTIVIRAL AGENTS GLAXOSMITHKLINE LLC (US) 2012-03-22 WO disclosed