SCHEMBL7326995

SCHEMBL7326995

O=[N+]([O-])c1cc(Cl)cc(S(=O)(=O)N(Cc2ccccc2)c2ccccc2)c1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.58
LMNA P02545 2/20 0.54
MAPT P10636 1/20 0.54
MEN1 O00255 5/20 0.54
KMT2A Q03164 5/20 0.54
ESR1 P03372 1/20 0.53
PGR P06401 2/20 0.52
PKM P14618 2/20 0.50
S1PR1 P21453 1/20 0.50
ALDH1A1 P00352 1/20 0.48
HIF1A Q16665 1/20 0.48
EPAS1 Q99814 1/20 0.48
CNR2 P34972 2/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
GAA P10253 1/20 0.46
HTT P42858 1/20 0.46
CNR1 P21554 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
SCHEMBL7335926 0.91 NR3C1 (0.64) NR3C1LMNAMAPTMEN1KMT2A
SCHEMBL7331497 0.88 NR3C1 (0.58) NR3C1LMNAMAPTMEN1KMT2A
SCHEMBL8543953 0.85 NR3C1 (0.58) NR3C1LMNAMAPTMEN1KMT2A
SCHEMBL7326548 0.82 NR3C1 (0.60) NR3C1LMNAMAPTESR1PGR
SCHEMBL8549210 0.81 NR3C1 (0.64) NR3C1LMNAMAPTMEN1KMT2A
SCHEMBL8544327 0.80 PGR (0.56) NR3C1LMNAMEN1KMT2AESR1
SCHEMBL7330183 0.80 CA12 (0.50) MEN1KMT2APGRS1PR1L3MBTL1
SCHEMBL8549652 0.80 ESR1 (0.66) NR3C1LMNAMAPTMEN1KMT2A
SCHEMBL6553024 0.79 PKM (0.75) NR3C1LMNAMAPTMEN1KMT2A
SCHEMBL7336428 0.76 NR3C1 (0.58) NR3C1LMNAMAPTMEN1KMT2A

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1046710-C New 4-aminopyridines, process for preparing the same and medicaments containing the same LUOHE DIAGNOSTIC EQUIPMENT CO (DE) 1999-11-24 CN disclosed
EP-0687253-B1 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1998-12-16 EP disclosed
CN-1119858-A Aminopyridines, process for their preparation and pharmaceutical compositions containing them BOEHRINGER MANNHEIM GMBH (DE) 1996-04-03 CN disclosed
EP-0687253-A1 NEW 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME Roche Diagnostics GmbH (DE) 1995-12-20 EP disclosed
WO-1994020467-A1 NEW 4-AMINOPYRIDINES, PROCESS FOR PREPARING THE SAME AND MEDICAMENTS CONTAINING THE SAME BOEHRINGER MANNHEIM GMBH (DE) 1994-09-15 WO disclosed