SCHEMBL5117768

SCHEMBL5117768

COc1ccc(S(=O)(=O)N(C)CCOCC(=O)O)c(Cl)c1

nearest known ligand 0.57

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 11/20 0.57
ACLY P53396 1/20 0.43
GSTO1 P78417 2/20 0.43
ALDH1A1 P00352 2/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LMNA P02545 2/20 0.41
TSHR P16473 1/20 0.41
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
PTGDR2 Q9Y5Y4 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
SCHEMBL15372721 0.87 BDKRB1 (0.57) BDKRB1LMNATSHR
SCHEMBL493089 0.87 ALDH1A1 (0.52) BDKRB1GSTO1ALDH1A1L3MBTL1TSHR
SCHEMBL4484352 0.84 BDKRB1 (0.51) BDKRB1
SCHEMBL4467182 0.83 CNR2 (0.44) BDKRB1LMNAKEAP1NFE2L2PTGDR2
SCHEMBL11947869 0.83 ALDH1A1 (0.59) BDKRB1ACLYALDH1A1L3MBTL1LMNA
SCHEMBL5114284 0.82 HTT (0.48) BDKRB1GSTO1ALDH1A1L3MBTL1LMNA
SCHEMBL4028398 0.81 ACLY (0.49) BDKRB1ACLYGSTO1ALDH1A1LMNA
SCHEMBL493487 0.80 KEAP1 (0.52) ALDH1A1LMNAKEAP1NFE2L2
SCHEMBL6184726 0.80 ACLY (0.47) BDKRB1ACLYGSTO1ALDH1A1L3MBTL1
SCHEMBL14033580 0.80 ALDH1A1 (0.43) BDKRB1GSTO1ALDH1A1L3MBTL1TSHR

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
US-7361687-B2 Arylsulphonamide derivatives and methods of preparing LABORATOIRES FOURNIER SA (FR) 2008-04-22 US disclosed
US-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents LABORATOIRES FOURNIER SA (FR) 2006-04-20 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-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents UGT1A1, UGT2B7, UGT1A6 BDKRB1 1217/4885ACLY 2523/4885GSTO1 392/4885

“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.