SCHEMBL7356754

SCHEMBL7356754

O=S(=O)(Cl)Cl.O=[N+]([O-])c1cccc(OCc2ccccc2)c1

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.60
MAOB P27338 4/20 0.56
MAPT P10636 3/20 0.54
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
LMNA P02545 1/20 0.54
CTSV O60911 2/20 0.54
CTSL P07711 2/20 0.54
MAOA P21397 3/20 0.53
TLR4 O00206 1/20 0.53
TLR2 O60603 1/20 0.53
FAAH O00519 2/20 0.52
ALDH1A1 P00352 1/20 0.52
RAB9A P51151 1/20 0.52
CYP19A1 P11511 2/20 0.51

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
SCHEMBL2965418 0.93 MAOB (0.63) ARMAOBMAPTMEN1KMT2A
SCHEMBL30443578 0.93 MAOB (0.63) ARMAOBMAPTMEN1KMT2A
SCHEMBL25920602 0.90 MAOB (0.64) ARMAOBMAPTMEN1KMT2A
SCHEMBL25920598 0.89 MAPT (0.62) ARMAOBMAPTMEN1KMT2A
Hydroquinone SCHEMBL29014236 0.87 MAOB (0.61) ARMAOBMAPTMEN1KMT2A
Acetonitrile SCHEMBL28336082 0.85 MAOB (0.62) ARMAOBMAPTMEN1KMT2A
SCHEMBL2872357 0.84 MEN1 (0.58) ARMAOBMAPTMEN1KMT2A
SCHEMBL6599866 0.84 MAOB (0.68) ARMAOBMAPTMEN1KMT2A
SCHEMBL18304358 0.83 MAOB (0.62) MAOBMAPTMEN1KMT2ALMNA
SCHEMBL4747135 0.82 MAPT (0.55) ARMAOBMAPTMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101133026-B 1- sulfonyl-pi perdine- 3 -carboxyl i c acid amide derivatives as inhibitors of 11-beta-hydroxysteroid dehydrogenase for the treatment of type ii diabetes mellitus HOFFMANN LA ROCHE 2011-07-06 CN disclosed
CN-101133026-A 1- sulfonyl-pi perdine- 3 -carboxyl i c acid amide derivatives as inhibitors of 11-beta-hydroxysteroid dehydrogenase for the treatment of type ii diabetes mellitus HOFFMANN LA ROCHE (CH) 2008-02-27 CN disclosed
EP-1054877-A1 NOVEL CYCLIC SULFONAMIDE DERIVATIVES AS METALLOPROTEINASE INHIBITORS Du Pont Pharmaceuticals Company (US) 2000-11-29 EP disclosed
WO-1999041246-A1 NOVEL CYCLIC SULFONAMIDE DERIVATIVES AS METALLOPROTEINASE INHIBITORS DU PONT PHARMACEUTICALS COMPANY (US) 1999-08-19 WO disclosed