SCHEMBL7594976

SCHEMBL7594976

O=S(=O)(Nc1cc(Br)c(Br)cc1NS(=O)(=O)c1ccc(Br)cc1)c1ccc(Br)cc1.O=S(=O)(Nc1ccc(Br)c(Br)c1)c1ccc(-c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UQCRB P14927 2/20 0.51
ALOX12 P18054 1/20 0.51
ITGA1 P56199 1/20 0.50
HSD17B2 P37059 1/20 0.49
GAA P10253 2/20 0.48
MAPT P10636 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
MAPK1 P28482 1/20 0.48
HTT P42858 1/20 0.48
RECQL P46063 1/20 0.48
GFER P55789 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
TP53 P04637 1/20 0.46
AVPR2 P30518 1/20 0.46
GPR27 Q9NS67 1/20 0.46
AR P10275 1/20 0.46
PTPN2 P17706 1/20 0.46
PTPN1 P18031 1/20 0.46
PTPN5 P54829 1/20 0.46

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
SCHEMBL7590886 0.86 MEN1 (0.61) UQCRBHSD17B2GAAMAPTMEN1
SCHEMBL7589388 0.80 CCR2 (0.54) HSD17B2GAAMEN1KMT2ATP53
SCHEMBL13028659 0.79 KMT2A (0.67) UQCRBALOX12ITGA1HSD17B2GAA
SCHEMBL25212958 0.74 PKM (0.74) MAPTMEN1KMT2AARALDH1A1
SCHEMBL1857218 0.74 KMT2A (0.74) ALOX12ITGA1HSD17B2GAAMEN1
SCHEMBL7213023 0.73 SLC10A6 (0.73) ALOX12MAPTMEN1KMT2AHTT
SCHEMBL7577405 0.73 PTPRC (0.60) ALOX12GAAMAPTMEN1KMT2A
SCHEMBL23109349 0.73 CA1 (0.65) MAPTMEN1KMT2AHTTALDH1A1
SCHEMBL812691 0.73 POLB (0.67) UQCRBMAPTMEN1KMT2AHTT
SCHEMBL7577210 0.72 HTT (0.62) ITGA1GAAMAPTMEN1KMT2A

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