SCHEMBL4629893

SCHEMBL4629893

O=C(O)[C@@H]1CSCN1S(=O)(=O)c1cc(Cl)cc(Cl)c1O

nearest known ligand 0.48

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ACLY P53396 15/20 0.48
ALDH1A1 P00352 1/20 0.48
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MMP2 P08253 2/20 0.40
MMP9 P14780 2/20 0.40
MMP1 P03956 1/20 0.40
MMP3 P08254 1/20 0.40
F2 P00734 1/20 0.38
PRSS1 P07477 1/20 0.38
PRSS2 P07478 1/20 0.38
PRSS3 P35030 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
SCHEMBL4629026 1.00 ACLY (0.48) ACLYALDH1A1CA1CA2MMP2
SCHEMBL4627858 0.88 ALDH1A1 (0.47) ACLYALDH1A1MMP2MMP9MMP1
SCHEMBL4629234 0.88 ALDH1A1 (0.47) ACLYALDH1A1MMP2MMP9MMP1
SCHEMBL4629891 0.88 ALDH1A1 (0.47) ACLYALDH1A1MMP2MMP9MMP1
SCHEMBL4629590 0.88 ALDH1A1 (0.47) ACLYALDH1A1MMP2MMP9MMP1
SCHEMBL4629060 0.85 ALDH1A1 (0.48) ACLYALDH1A1MMP2MMP9MMP1
SCHEMBL4629244 0.85 ALDH1A1 (0.48) ACLYALDH1A1MMP2MMP9MMP1
SCHEMBL7228300 0.80 MMP2 (0.49) ALDH1A1MMP2MMP9MMP1MMP3
SCHEMBL7237508 0.80 MMP2 (0.49) ALDH1A1MMP2MMP9MMP1MMP3
SCHEMBL7228302 0.80 MMP2 (0.49) ALDH1A1MMP2MMP9MMP1MMP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1981845-A2 SULFONAMIDE DERIVATIVES TO TREAT INFECTION WITH HEPATITIS C VIRUS Wyeth (US) 2008-10-22 EP claimed
US-20070225344-A1 Sulfonamide derivatives to treat infection with hepatitis C virus WYETH 2007-09-27 US claimed
WO-2007092558-A2 SULFONAMIDE DERIVATIVES TO TREAT INFECTION WITH HEPATITIS C VIRUS WYETH (US) 2007-08-16 WO claimed
EP-1981845-A2 SULFONAMIDE DERIVATIVES TO TREAT INFECTION WITH HEPATITIS C VIRUS Wyeth (US) 2008-10-22 EP disclosed
US-20070225344-A1 Sulfonamide derivatives to treat infection with hepatitis C virus WYETH 2007-09-27 US disclosed
WO-2007092558-A2 SULFONAMIDE DERIVATIVES TO TREAT INFECTION WITH HEPATITIS C VIRUS WYETH (US) 2007-08-16 WO 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-20070225344-A1 Sulfonamide derivatives to treat infection with hepatitis C virus HCCS, HAVCR2, SULT2A1 ACLY 2581/4885ALDH1A1 907/4885CA1 626/4885

“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.