SCHEMBL7571583

SCHEMBL7571583

Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccccc1O

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.63
KMT2A Q03164 4/20 0.63
SMN1; SMN2 Q16637 3/20 0.63
MAPT P10636 3/20 0.63
HTT P42858 3/20 0.63
LMNA P02545 2/20 0.63
DDX3X O00571 1/20 0.63
SLC5A1 P13866 1/20 0.63
NCOA1 Q15788 1/20 0.63
NCOA3 Q9Y6Q9 1/20 0.63
NFKBIA P25963 1/20 0.61
RELA Q04206 1/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
ALDH1A1 P00352 3/20 0.56
MAPK1 P28482 2/20 0.56
ACHE P22303 1/20 0.52
MCL1 Q07820 2/20 0.52
GUSB P08236 1/20 0.50
PDE2A O00408 1/20 0.50
PDE5A O76074 1/20 0.50

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
SCHEMBL7571516 0.90 NFKBIA (0.62) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL3470566 0.88 SMN1; SMN2 (0.67) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL15647549 0.85 NFKBIA (0.61) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL7572373 0.81 L3MBTL1 (0.67) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL13510391 0.80 HSD11B1 (0.62) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL23832700 0.80 TSHR (0.58) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL30218132 0.80 TSHR (0.58) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL7580117 0.79 LMNA (0.66) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL18023815 0.79 DDX3X (0.74) MEN1KMT2ASMN1; SMN2MAPTHTT
SCHEMBL7571585 0.79 ALDH1A1 (0.66) MEN1KMT2ASMN1; SMN2MAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1239852-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS Arrow Therapeutics Limited (GB) 2002-09-18 EP disclosed
WO-2001028537-A2 BISSULFONAMIDE DERIVATIVES AS ENZYME INHIBITORS ARROW THERAPEUTICS LIMITED (GB) 2001-04-26 WO disclosed