SCHEMBL7592771

SCHEMBL7592771

O=S(=O)(Nc1ccccc1NS(=O)(=O)c1cccc(C(F)(F)F)c1)c1cccc(C(F)(F)F)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.74
KMT2A Q03164 3/20 0.74
GAA P10253 1/20 0.74
LMNA P02545 2/20 0.67
NPSR1 Q6W5P4 1/20 0.67
SLC40A1 Q9NP59 1/20 0.67
CA1 P00915 1/20 0.66
CA2 P00918 1/20 0.66
MMP1 P03956 1/20 0.66
MMP2 P08253 1/20 0.66
MMP9 P14780 1/20 0.66
MMP8 P22894 1/20 0.66
MMP13 P45452 1/20 0.66
PTGES2 Q9H7Z7 2/20 0.65
CLK1 P49759 1/20 0.65
ACLY P53396 1/20 0.62
NR3C1 P04150 1/20 0.62
PGR P06401 1/20 0.62
AR P10275 1/20 0.62
ESR2 Q92731 1/20 0.62

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
SCHEMBL7572596 0.94 MEN1 (0.67) MEN1KMT2AGAALMNANPSR1
SCHEMBL10143421 0.93 MEN1 (0.66) MEN1KMT2AGAALMNANPSR1
SCHEMBL10622385 0.90 MEN1 (0.66) MEN1KMT2AGAALMNANPSR1
SCHEMBL7572994 0.89 SLC40A1 (0.66) MEN1KMT2AGAALMNANPSR1
SCHEMBL7572582 0.88 CLK1 (0.67) MEN1KMT2AGAALMNANPSR1
SCHEMBL7580383 0.88 MCL1 (0.68) MEN1KMT2AGAALMNANPSR1
SCHEMBL7570746 0.88 MCL1 (0.64) MEN1KMT2AGAALMNANPSR1
SCHEMBL7594309 0.87 KMT2A (0.63) MEN1KMT2AGAALMNANPSR1
SCHEMBL10530997 0.87 ALDH1A1 (0.64) MEN1KMT2AGAALMNANPSR1
SCHEMBL10585396 0.87 PTGES2 (0.66) MEN1KMT2AGAALMNANPSR1

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