SCHEMBL7589405

SCHEMBL7589405

O=S(=O)(Nc1ccccc1NS(=O)(=O)c1ccc(Br)cc1)c1ccc(Br)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.59
KMT2A Q03164 3/20 0.59
TDP1 Q9NUW8 1/20 0.59
EP300 Q09472 1/20 0.56
CA1 P00915 1/20 0.55
CA2 P00918 1/20 0.55
MMP1 P03956 1/20 0.55
MMP2 P08253 1/20 0.55
MMP9 P14780 1/20 0.55
MMP8 P22894 1/20 0.55
MMP13 P45452 1/20 0.55
ALDH1A1 P00352 3/20 0.55
L3MBTL1 Q9Y468 2/20 0.55
USP2 O75604 1/20 0.55
LMNA P02545 1/20 0.55
POLB P06746 1/20 0.55
MAPT P10636 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
NOD2 Q9HC29 1/20 0.55

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
SCHEMBL15145878 0.87 MEN1 (0.52) MEN1KMT2ATDP1EP300CA1
SCHEMBL3081594 0.87 ALDH1A1 (0.71) MEN1KMT2AALDH1A1L3MBTL1USP2
SCHEMBL22252403 0.86 KEAP1 (0.69) MEN1KMT2AEP300
SCHEMBL27826958 0.84 MCOLN3 (0.72) MEN1KMT2ATDP1EP300CA1
SCHEMBL22345889 0.84 ALDH1A1 (0.68) MEN1KMT2ATDP1ALDH1A1L3MBTL1
SCHEMBL3783869 0.84 CA1 (0.74) CA1CA2
SCHEMBL2835167 0.83 POLB (0.66) MEN1KMT2AALDH1A1L3MBTL1LMNA
SCHEMBL15770989 0.83 KMT2A (0.68) MEN1KMT2ATDP1EP300ALDH1A1
SCHEMBL28261753 0.83 ALDH1A1 (0.54) MEN1KMT2ATDP1EP300CA2
SCHEMBL2067538 0.82 ALDH1A1 (0.68) MEN1KMT2ATDP1ALDH1A1L3MBTL1

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