SCHEMBL688272

SCHEMBL688272

O=S(=O)(O)C=Cc1ccc(OS(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.46
NFE2L2 Q16236 3/20 0.45
LMNA P02545 1/20 0.45
PTGS2 P35354 1/20 0.41
CXCR2 P25025 2/20 0.40
CXCR1 P25024 1/20 0.40
CISD1 Q9NZ45 1/20 0.37
PTPN1 P18031 1/20 0.37
STS P08842 2/20 0.36
ABL1 P00519 1/20 0.36
EGFR P00533 1/20 0.36
ABL2 P42684 1/20 0.36
DRD2 P14416 1/20 0.36
DRD3 P35462 1/20 0.36

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
SCHEMBL688271 1.00 PPARG (0.46) PPARGNFE2L2LMNAPTGS2CXCR2
SCHEMBL687781 0.98 PPARG (0.45) PPARGNFE2L2LMNAPTGS2CXCR2
SCHEMBL687782 0.98 PPARG (0.45) PPARGNFE2L2LMNAPTGS2CXCR2
SCHEMBL6457046 0.87 KIF11 (0.46) PPARGNFE2L2LMNACXCR2CXCR1
SCHEMBL6457049 0.87 KIF11 (0.46) PPARGNFE2L2LMNACXCR2CXCR1
SCHEMBL687780 0.85 PPARG (0.45) PPARGNFE2L2LMNAPTGS2CXCR2
SCHEMBL31051131 0.85 PPARG (0.47) PPARGNFE2L2LMNAPTGS2CXCR2
SCHEMBL687984 0.83 PPARG (0.46) PPARGNFE2L2LMNAPTGS2CXCR2
SCHEMBL687983 0.83 PPARG (0.46) PPARGNFE2L2LMNAPTGS2CXCR2
SCHEMBL6453964 0.81 CXCR2 (0.37) PPARGNFE2L2PTGS2CXCR2CXCR1

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-1606248-B1 SULFONIC ACIDS, THEIR DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DOMPE SPA (IT) 2012-02-29 EP claimed
US-7737139-B2 Sulfonic acids, their derivatives and pharmaceutical compositions containing them DOMPE PHA.R.MA S.P.A. (IT) 2010-06-15 US claimed
US-20060258730-A1 Sulfonic acids, their derivatives and pharmaceutical compositions containing them DOMPE S.P.A. (IT) 2006-11-16 US claimed
EP-1606248-B1 SULFONIC ACIDS, THEIR DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM DOMPE SPA (IT) 2012-02-29 EP disclosed
US-7737139-B2 Sulfonic acids, their derivatives and pharmaceutical compositions containing them DOMPE PHA.R.MA S.P.A. (IT) 2010-06-15 US disclosed
US-20060258730-A1 Sulfonic acids, their derivatives and pharmaceutical compositions containing them DOMPE S.P.A. (IT) 2006-11-16 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-20060258730-A1 Sulfonic acids, their derivatives and pharmaceutical compositions containing them CCR8, CCR1, CXCR1 PPARG 117/4885NFE2L2 2296/4885LMNA 4081/4885

“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.