SCHEMBL8549652

SCHEMBL8549652

O=S(=O)(c1cc(O)cc(Cl)c1)N(Cc1ccccc1)c1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.66
MEN1 O00255 6/20 0.58
KMT2A Q03164 6/20 0.58
PGR P06401 2/20 0.56
ALDH1A1 P00352 1/20 0.55
LMNA P02545 1/20 0.55
S1PR1 P21453 1/20 0.54
NR3C1 P04150 2/20 0.53
PKM P14618 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.51
CNR2 P34972 2/20 0.50
GAA P10253 1/20 0.50
HTT P42858 1/20 0.50
CNR1 P21554 1/20 0.50
NR1I2 O75469 1/20 0.49
PTGES O14684 1/20 0.48
ALOX5 P09917 1/20 0.48
MAPT P10636 1/20 0.47
RORC P51449 1/20 0.47

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
SCHEMBL7333684 0.86 ESR1 (0.62) ESR1MEN1KMT2APGRALDH1A1
SCHEMBL8544327 0.84 PGR (0.56) ESR1MEN1KMT2APGRALDH1A1
SCHEMBL7326459 0.81 PGR (0.62) ESR1MEN1KMT2APGRALDH1A1
SCHEMBL27593108 0.80 ESR1 (1.00) ESR1MEN1KMT2APGRALDH1A1
SCHEMBL7326995 0.80 NR3C1 (0.58) ESR1MEN1KMT2APGRALDH1A1
SCHEMBL7332305 0.79 PGR (0.55) ESR1MEN1KMT2APGRALDH1A1
SCHEMBL7334051 0.79 MEN1 (0.54) ESR1MEN1KMT2APGRALDH1A1
SCHEMBL5330652 0.77 ESR1 (0.78) ESR1MEN1KMT2APGRALDH1A1
SCHEMBL7332897 0.77 KDM4E (0.52) PGRLMNAS1PR1L3MBTL1HTT
SCHEMBL6295367 0.77 ESR1 (0.88) ESR1MEN1KMT2APGRALDH1A1

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 3 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