SCHEMBL7566450

SCHEMBL7566450

O=S(=O)(Nc1ccc(-c2ccccc2F)cc1NS(=O)(=O)c1ccc(Cl)s1)c1ccc(Cl)s1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGAM1 P18669 1/20 0.51
PTGES2 Q9H7Z7 1/20 0.50
MCOLN3 Q8TDD5 2/20 0.46
ALDH1A1 P00352 2/20 0.46
MEN1 O00255 4/20 0.45
KMT2A Q03164 4/20 0.45
LMNA P02545 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
MAPT P10636 1/20 0.45
NFKBIA P25963 2/20 0.44
RELA Q04206 2/20 0.44
CCR2 P41597 2/20 0.43
HTT P42858 2/20 0.43
GHSR Q92847 1/20 0.43
CRHBP P24387 1/20 0.43
CRHR2 Q13324 1/20 0.43
THRB P10828 2/20 0.42
BLM P54132 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
F10 P00742 1/20 0.42

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
SCHEMBL7593138 0.83 PTGES2 (0.56) PGAM1PTGES2MCOLN3ALDH1A1MEN1
SCHEMBL7567304 0.83 PGAM1 (0.48) PGAM1PTGES2MCOLN3ALDH1A1MEN1
SCHEMBL7571625 0.80 PTGES2 (0.65) PGAM1PTGES2MCOLN3ALDH1A1MEN1
SCHEMBL7567353 0.79 PTGES2 (0.50) PGAM1PTGES2MCOLN3ALDH1A1MEN1
SCHEMBL7573886 0.79 THRB (0.56) PGAM1PTGES2MCOLN3ALDH1A1MEN1
SCHEMBL7573029 0.78 PTGES2 (0.74) PGAM1PTGES2MCOLN3ALDH1A1MEN1
SCHEMBL7567262 0.77 CCR2 (0.55) PGAM1PTGES2MEN1KMT2ALMNA
SCHEMBL7567408 0.77 ACLY (0.50) PGAM1PTGES2MCOLN3ALDH1A1MEN1
SCHEMBL7607342 0.77 CCR9 (0.43) PGAM1PTGES2HSPD1PTPN2PTPN1
SCHEMBL7565918 0.76 ACLY (0.54) PGAM1PTGES2MCOLN3ALDH1A1MEN1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2002083629-A1 BISSULFONAMIDE DERIVATIVES AS INHIBITORS OF DEHYDROQUINATE SYNTHETASES AND TYPE II DEHYDROQUINASES ARROW THERAPEUTICS LIMITED (GB) 2002-10-24 WO disclosed