SCHEMBL7590087

SCHEMBL7590087

O=S(=O)(Nc1ccc(-c2ccsc2)cc1NS(=O)(=O)c1ccc(Cl)s1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 1/20 0.44
PTPN2 P17706 6/20 0.41
PTPN1 P18031 6/20 0.41
PTPN5 P54829 6/20 0.41
ALDH1A1 P00352 1/20 0.40
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
FFAR4 Q5NUL3 1/20 0.40
CCR9 P51686 4/20 0.40
RORC P51449 1/20 0.38
HSPD1 P10809 2/20 0.38
HSPE1 P61604 2/20 0.38
CHRM5 P08912 1/20 0.38
FBP1 P09467 1/20 0.38

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
SCHEMBL7595317 0.90 ACLY (0.40) GSK3BPTPN2PTPN1PTPN5MEN1
SCHEMBL7565871 0.88 GSK3B (0.46) GSK3BPTPN2PTPN1PTPN5ALDH1A1
SCHEMBL7572797 0.85 ACLY (0.49) GSK3BPTPN2PTPN1PTPN5FFAR4
SCHEMBL7574296 0.85 ALDH1A1 (0.46) PTPN2PTPN1PTPN5ALDH1A1MEN1
SCHEMBL7569198 0.84 CCR9 (0.44) GSK3BPTPN2PTPN1PTPN5ALDH1A1
SCHEMBL7607342 0.83 CCR9 (0.43) GSK3BPTPN2PTPN1PTPN5CCR9
SCHEMBL7584723 0.82 PTPN2 (0.41) GSK3BPTPN2PTPN1PTPN5ALDH1A1
SCHEMBL7572678 0.82 GSK3B (0.42) GSK3BPTPN2PTPN1PTPN5FFAR4
SCHEMBL7568371 0.82 GSK3B (0.42) GSK3BPTPN2PTPN1PTPN5ALDH1A1
SCHEMBL7567130 0.82 GSK3B (0.45) GSK3BPTPN2PTPN1PTPN5ALDH1A1

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