SCHEMBL4619094

SCHEMBL4619094

O=S(=O)(O)/C=C/c1ccccc1Cl

nearest known ligand 0.53

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NFE2L2 Q16236 12/20 0.53
KCNH2 Q12809 1/20 0.51
PTGES2 Q9H7Z7 1/20 0.49
HDAC1 Q13547 1/20 0.49
HDAC8 Q9BY41 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
GSR P00390 1/20 0.49
MAPT P10636 2/20 0.45
NPC1 O15118 1/20 0.45
MAOB P27338 1/20 0.45
RAB9A P51151 1/20 0.45
MEN1 O00255 1/20 0.45
HSP90AA1 P07900 1/20 0.45
KMT2A Q03164 1/20 0.45
ALDH1A1 P00352 1/20 0.43
CA12 O43570 1/20 0.43
CA9 Q16790 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
SCHEMBL2724442 1.00 NFE2L2 (0.53) NFE2L2KCNH2PTGES2HDAC1HDAC8
SCHEMBL11670632 0.82 NFE2L2 (0.51) NFE2L2KCNH2PTGES2HDAC1HDAC8
SCHEMBL3774311 0.82 NFE2L2 (0.54) NFE2L2KCNH2PTGES2HDAC1HDAC8
SCHEMBL3774314 0.82 NFE2L2 (0.54) NFE2L2KCNH2PTGES2HDAC1HDAC8
SCHEMBL4619406 0.81 MAPT (0.45) NFE2L2KCNH2PTGES2MAPTNPC1
SCHEMBL4619162 0.80 PTGES2 (0.56) NFE2L2KCNH2PTGES2HDAC1HDAC8
SCHEMBL4619165 0.80 PTGES2 (0.56) NFE2L2KCNH2PTGES2HDAC1HDAC8
SCHEMBL28849997 0.79 KMT2A (0.48) NFE2L2PTGES2MAPTNPC1RAB9A
SCHEMBL28849973 0.79 KMT2A (0.48) NFE2L2PTGES2MAPTNPC1RAB9A
SCHEMBL4619057 0.79 CA12 (0.48) NFE2L2KCNH2PTGES2HDAC1HDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101268042-A Styryl sulfonamides, their preparation and use as pharmaceutical agents HOFFMANN LA ROCHE (CH) 2008-09-17 CN disclosed
EP-1888519-A2 STYRYLSULFONAMIDES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2008-02-20 EP disclosed
WO-2007054139-A2 STYRYLSULFONAMIDES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2007-05-18 WO disclosed
US-7208526-B2 For example, (E)-2-(4-Chloro-phenyl)-ethenesulfonic acid 2,4-dichloro-benzoylamide; for use in the control or prevention of illnesses such as cancer; antitumor agents HOFFMANN-LA ROCHE INC. (US) 2007-04-24 US disclosed
US-20060270874-A1 Styrylsulfonamides HOFFMANN-LA ROCHE INC. 2006-11-30 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20060270874-A1 Styrylsulfonamides STS, SULT1E1, BRCA1 NFE2L2 1842/4885KCNH2 830/4885PTGES2 3551/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.