SCHEMBL790975

SCHEMBL790975

CCOC(=O)c1ccc(-c2cc3cc(-c4cnc(OC)c(NS(=O)(=O)c5ccc(F)cc5F)c4)ccc3nc2N)cc1

nearest known ligand 0.77

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 8/20 0.77
PI4KA P42356 6/20 0.77
PIK3CA P42336 14/20 0.61
MTOR P42345 7/20 0.61
HDAC1 Q13547 1/20 0.55
PIK3R1 P27986 3/20 0.54
PIK3CD O00329 2/20 0.54
PIK3CB P42338 2/20 0.54
PRKDC P78527 1/20 0.54
PDE4D Q08499 1/20 0.54
RICTOR Q6R327 1/20 0.54
RPTOR Q8N122 1/20 0.54
PIK3C3 Q8NEB9 1/20 0.54
PIP4K2C Q8TBX8 1/20 0.54
MAPKAP1 Q9BPZ7 1/20 0.54
MLST8 Q9BVC4 1/20 0.54
IRAK3 Q9Y616 1/20 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
SCHEMBL789386 0.93 PIK3CG (0.82) PIK3CGPI4KAPIK3CAMTORHDAC1
SCHEMBL806733 0.93 PIK3CG (0.75) PIK3CGPI4KAPIK3CAMTORHDAC1
SCHEMBL807154 0.90 PIK3CG (0.82) PIK3CGPI4KAPIK3CAMTORHDAC1
SCHEMBL791474 0.90 PIK3CG (0.70) PIK3CGPI4KAPIK3CAMTORHDAC1
SCHEMBL807070 0.89 PIK3CG (0.80) PIK3CGPI4KAPIK3CAMTORHDAC1
SCHEMBL807106 0.88 PIK3CG (0.76) PIK3CGPI4KAPIK3CAMTORHDAC1
SCHEMBL791170 0.87 PIK3CG (0.82) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL789570 0.87 PIK3CG (1.00) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL789429 0.87 PIK3CG (0.81) PIK3CGPI4KAPIK3CAMTORPIK3R1
SCHEMBL790415 0.86 PIK3CG (0.74) PIK3CGPI4KAPIK3CAMTORHDAC1

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