SCHEMBL7573869

SCHEMBL7573869

O=S(=O)(NCOc1ccccc1)c1ccc(OCF)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.54
KMT2A Q03164 2/20 0.54
HTT P42858 1/20 0.54
ALDH1A1 P00352 5/20 0.48
ADAMTS4 O75173 3/20 0.47
MMP2 P08253 3/20 0.47
MMP13 P45452 3/20 0.47
MMP14 P50281 3/20 0.47
ADAMTS5 Q9UNA0 3/20 0.47
MMP1 P03956 2/20 0.47
MEP1B Q16820 1/20 0.47
MMP9 P14780 1/20 0.46
ADAM17 P78536 1/20 0.46
MAPT P10636 1/20 0.46
POLB P06746 1/20 0.44
TBXA2R P21731 1/20 0.44
TBXAS1 P24557 1/20 0.44
AR P10275 1/20 0.44
CA12 O43570 1/20 0.43
CA1 P00915 1/20 0.43

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
SCHEMBL2595618 0.87 ALDH1A1 (0.55) MEN1KMT2AHTTALDH1A1MAPT
SCHEMBL7571617 0.86 TAAR1 (0.56) MEN1KMT2AHTTALDH1A1AR
SCHEMBL7572313 0.83 CA12 (0.59) MEN1KMT2AHTTALDH1A1MAPT
SCHEMBL7570427 0.82 AR (0.57) MEN1KMT2AHTTALDH1A1ADAMTS4
SCHEMBL7570456 0.79 MEN1 (0.51) MEN1KMT2AHTTALDH1A1MAPT
SCHEMBL7580123 0.76 PGR (0.57) MEN1KMT2AHTTALDH1A1MAPT
SCHEMBL1714596 0.73
SCHEMBL16451223 0.71 MEN1 (0.55) MEN1KMT2AHTTALDH1A1POLB
SCHEMBL7574913 0.71 ALOX15 (0.45) MEN1KMT2AALDH1A1
SCHEMBL4519542 0.71 HTT (0.71) MEN1KMT2AHTTALDH1A1MMP2

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