SCHEMBL4285883

SCHEMBL4285883

CCCCOc1c(Nc2nc3ccccc3nc2NS(=O)(=O)c2ccn(CCC)n2)cc(OC)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.54
PIK3CG P48736 16/20 0.50
MAPT P10636 2/20 0.47
KMT2A Q03164 1/20 0.46

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
SCHEMBL4292331 0.89 PIK3CD (0.53) PIK3CDPIK3CGMAPTKMT2A
SCHEMBL18175028 0.88 PIK3CG (0.51) PIK3CDPIK3CGMAPT
SCHEMBL4292830 0.87 PIK3CG (0.51) PIK3CDPIK3CG
SCHEMBL2732860 0.85 PIK3CG (0.54) PIK3CDPIK3CG
SCHEMBL15199261 0.84 PIK3CG (0.47) PIK3CDPIK3CGMAPT
SCHEMBL2722409 0.83 PIK3CG (0.50) PIK3CDPIK3CGMAPT
SCHEMBL15194173 0.83 PIK3CG (0.48) PIK3CDPIK3CG
SCHEMBL4288277 0.82 PIK3CD (0.57) PIK3CDPIK3CGMAPTKMT2A
SCHEMBL4297407 0.82 PIK3CD (0.50) PIK3CDPIK3CGMAPTKMT2A
SCHEMBL4290396 0.82 PIK3CD (0.50) PIK3CDPIK3CGMAPTKMT2A

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-2012052102-A1 QUINOXALINE DERIVATES MERCK PATENT GMBH (DE) 2012-04-26 WO disclosed