SCHEMBL7578587

SCHEMBL7578587

O=[N+]([O-])c1ccc(F)cc1NS(=O)(=O)c1cccc(C(F)(F)F)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.52
GAA P10253 2/20 0.52
KMT2A Q03164 2/20 0.52
LMNA P02545 3/20 0.50
NPSR1 Q6W5P4 2/20 0.50
SLC40A1 Q9NP59 2/20 0.50
CA1 P00915 1/20 0.50
CA2 P00918 1/20 0.50
MMP1 P03956 1/20 0.50
MMP2 P08253 1/20 0.50
MMP9 P14780 1/20 0.50
MMP8 P22894 1/20 0.50
MMP13 P45452 1/20 0.50
CLK1 P49759 1/20 0.49
ALDH1A1 P00352 3/20 0.48
MAPT P10636 3/20 0.48
HTT P42858 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
ALOX12 P18054 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48

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
SCHEMBL3624463 0.84 ALDH1A1 (0.64) MEN1KMT2ASLC40A1CA2ALDH1A1
SCHEMBL7577554 0.81 MEN1 (0.55) MEN1GAAKMT2ALMNANPSR1
SCHEMBL7568328 0.81 GAA (0.50) MEN1GAAKMT2ALMNANPSR1
SCHEMBL7572541 0.80 FFAR1 (0.62) MEN1GAAKMT2ALMNANPSR1
SCHEMBL3624288 0.78 CCR2 (0.50) MEN1KMT2ALMNAALDH1A1MAPT
SCHEMBL7569677 0.78 MEN1 (0.52) MEN1GAAKMT2ALMNANPSR1
SCHEMBL7594309 0.77 KMT2A (0.63) MEN1GAAKMT2ALMNANPSR1
SCHEMBL7592771 0.77 MEN1 (0.74) MEN1GAAKMT2ALMNANPSR1
SCHEMBL7612721 0.76 CRHBP (0.70) MEN1GAAKMT2ALMNANPSR1
SCHEMBL7572806 0.76 NR3C1 (0.69) MEN1GAAKMT2ALMNACA1

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