SCHEMBL18175023

SCHEMBL18175023

C=N/C=N\C(=C/C)S(=O)(=O)Nc1nc2ccccc2nc1Nc1cc(OC)cc(OC)c1OCC[S+](C)[O-]

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.40
PIK3CG P48736 14/20 0.39
PIK3CD O00329 4/20 0.38
KMT2A Q03164 1/20 0.37

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
SCHEMBL18167147 0.77 PIK3CG (0.39) MAPTPIK3CGPIK3CDKMT2A
SCHEMBL2732047 0.76 PIK3CD (0.67) PIK3CGPIK3CD
SCHEMBL18167148 0.76 MAPT (0.38) MAPTPIK3CGPIK3CDKMT2A
SCHEMBL4285724 0.72 PIK3CG (0.66) PIK3CG
SCHEMBL15193717 0.70 MEN1 (0.34) MAPTPIK3CGKMT2A
SCHEMBL15193113 0.70 PIK3CG (0.62) MAPTPIK3CGPIK3CDKMT2A
SCHEMBL4287398 0.70 PIK3CG (0.53) MAPTPIK3CG
SCHEMBL4288292 0.70 PIK3CG (0.59) MAPTPIK3CGPIK3CD
SCHEMBL2721509 0.70 PIK3CG (0.55) MAPTPIK3CGPIK3CDKMT2A
SCHEMBL4294735 0.69 PIK3CG (0.52) MAPTPIK3CG

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
EP-2630129-B1 QUINOXALINE DERIVATES MERCK PATENT GMBH (DE) 2016-10-26 EP disclosed