SCHEMBL7589259

SCHEMBL7589259

CCOC(=O)c1ccccc1NS(=O)(=O)c1ccc(Cl)cc1OC.O=S(=O)(Nc1ccc(Cl)cc1NS(=O)(=O)c1cc(Cl)sc1Cl)c1cc(Cl)sc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.48
LMNA P02545 5/20 0.48
ALDH1A1 P00352 4/20 0.48
HTT P42858 3/20 0.48
TP53 P04637 2/20 0.48
HPGD P15428 2/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KMT2A Q03164 3/20 0.47
CYP2C9 P11712 1/20 0.46
PTGDR2 Q9Y5Y4 1/20 0.45
KDM4E B2RXH2 5/20 0.43
NPC1 O15118 2/20 0.43
GAA P10253 2/20 0.43
TDP1 Q9NUW8 1/20 0.43
CDC25B P30305 1/20 0.43
POLB P06746 2/20 0.42
ACLY P53396 1/20 0.42
MAPT P10636 3/20 0.41
MEN1 O00255 2/20 0.41

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
SCHEMBL7570508 0.77 TSHR (0.64) TSHRLMNAALDH1A1HTTTP53
SCHEMBL28677113 0.72 TP53 (0.53) TSHRLMNAALDH1A1TP53HPGD
SCHEMBL7573883 0.70 KMT2A (0.64) TSHRLMNAALDH1A1HTTTP53
SCHEMBL7593518 0.70 ACLY (0.61) CYP2C9TDP1ACLY
SCHEMBL38652788 0.68 TP53 (0.55) LMNAALDH1A1HTTTP53SMN1; SMN2
SCHEMBL12201314 0.68 METAP2 (0.61) LMNAALDH1A1HTTHPGDKMT2A
SCHEMBL12201985 0.68 KMT2A (0.56) TSHRLMNAALDH1A1HTTTP53
SCHEMBL7572290 0.66 LMNA (0.72) TSHRLMNAALDH1A1HTTTP53
SCHEMBL7149263 0.66 MAPT (0.58) LMNAALDH1A1HTTHPGDSMN1; SMN2
SCHEMBL7594909 0.66 NPC1 (0.89) TSHRLMNAALDH1A1HTTL3MBTL1

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