SCHEMBL7328258

SCHEMBL7328258

CN(c1ccccc1)S(=O)(=O)c1cc(N)cc(Cl)c1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.52
PGR P06401 4/20 0.52
CA12 O43570 1/20 0.51
CA9 Q16790 1/20 0.51
F2 P00734 1/20 0.48
MCOLN3 Q8TDD5 1/20 0.47
S1PR1 P21453 1/20 0.46
ATM Q13315 1/20 0.46
L3MBTL1 Q9Y468 1/20 0.46
GPR27 Q9NS67 1/20 0.45
ALDH1A1 P00352 1/20 0.44
HTR2C P28335 1/20 0.44
HTR2B P41595 1/20 0.44
LMNA P02545 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
TSHR P16473 1/20 0.43

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
SCHEMBL7326967 0.85 PGR (0.49) KDM4EPGRCA12CA9L3MBTL1
SCHEMBL7332897 0.82 KDM4E (0.52) KDM4EPGRCA12CA9F2
SCHEMBL11689577 0.81 KDM4E (0.55) KDM4EPGRCA12CA9MCOLN3
SCHEMBL7334990 0.81 PGR (0.59) KDM4EPGRCA12CA9ATM
SCHEMBL11307758 0.80 LMNA (0.57) PGRCA12CA9ATML3MBTL1
SCHEMBL7330183 0.77 CA12 (0.50) KDM4EPGRCA12CA9F2
SCHEMBL7333882 0.77 CA12 (0.50) PGRCA12CA9ATML3MBTL1
SCHEMBL8544327 0.77 PGR (0.56) PGRS1PR1L3MBTL1ALDH1A1LMNA
SCHEMBL11181741 0.77 PGR (0.74) KDM4EPGRCA12CA9MCOLN3
SCHEMBL2518894 0.77 CA12 (0.71) KDM4EPGRCA12CA9MCOLN3

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