SCHEMBL5424985

SCHEMBL5424985

COc1ccccc1/C=C/S(=O)(=O)O.Cc1ccc(C(N)=O)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ABCB1 P08183 2/20 0.46
ALOX5 P09917 1/20 0.44
PTGS1 P23219 1/20 0.44
PTGS2 P35354 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NFE2L2 Q16236 4/20 0.43
TFEB P19484 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
NR1H4 Q96RI1 3/20 0.42
KDM4E B2RXH2 1/20 0.42
PTGES2 Q9H7Z7 3/20 0.41
MAOB P27338 3/20 0.40
AR P10275 1/20 0.40

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
SCHEMBL5416380 0.89 AR (0.49) ALOX5PTGS1PTGS2SMN1; SMN2NFE2L2
SCHEMBL5414749 0.89 LY96 (0.44) ABCB1ALOX5PTGS1PTGS2SMN1; SMN2
SCHEMBL5409655 0.89 NPC1 (0.48) ABCB1ALOX5PTGS1PTGS2SMN1; SMN2
SCHEMBL5412818 0.84 NFE2L2 (0.41) SMN1; SMN2NFE2L2PTGES2
SCHEMBL27717896 0.84 NFE2L2 (0.41) SMN1; SMN2NFE2L2PTGES2
SCHEMBL27717766 0.83 CYP1A1 (0.41) SMN1; SMN2NFE2L2KDM4E
SCHEMBL5411577 0.83 CYP1A1 (0.41) SMN1; SMN2NFE2L2KDM4E
SCHEMBL4618136 0.82 NFE2L2 (0.48) SMN1; SMN2NFE2L2TFEBNR1H4KDM4E
SCHEMBL5416929 0.81 PTGES2 (0.48) NFE2L2TFEBNR1H4KDM4EPTGES2
SCHEMBL5409216 0.80 AR (0.49) NFE2L2TFEBNR1H4KDM4EPTGES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
US-20060270874-A1 Styrylsulfonamides HOFFMANN-LA ROCHE INC. 2006-11-30 US claimed
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 ABCB1 90/4885ALOX5 1529/4885PTGS1 2396/4885

“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.