SCHEMBL3823748

SCHEMBL3823748

COc1cc(Nc2nc3ccccc3nc2NS(=O)(=O)c2cn(C)cn2)cc(C(C)OC)c1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 19/20 0.70
PIK3CD O00329 1/20 0.64

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
SCHEMBL2304006 0.91 PIK3CG (0.80) PIK3CGPIK3CD
SCHEMBL3571234 0.85 PIK3CG (0.82) PIK3CGPIK3CD
SCHEMBL3577319 0.84 PIK3CG (0.81) PIK3CGPIK3CD
SCHEMBL3575258 0.82 PIK3CG (0.79) PIK3CGPIK3CD
SCHEMBL3581471 0.82 PIK3CG (0.79) PIK3CGPIK3CD
SCHEMBL3580657 0.82 PIK3CG (1.00) PIK3CGPIK3CD
SCHEMBL3567912 0.82 PIK3CG (0.77) PIK3CGPIK3CD
SCHEMBL3576051 0.82 PIK3CG (1.00) PIK3CGPIK3CD
SCHEMBL3582247 0.81 PIK3CG (0.76) PIK3CGPIK3CD
SCHEMBL3582160 0.80 PIK3CG (0.75) PIK3CGPIK3CD

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
EP-2118076-A1 QUINOXALINE COMPOUNDS AND USE THEREOF Merck Serono S.A. (CH) 2009-11-18 EP disclosed
WO-2008101979-A1 QUINOXALINE COMPOUNDS AND USE THEREOF MERCK SERONO S.A. (CH) 2008-08-28 WO disclosed