SCHEMBL10073567

SCHEMBL10073567

CNS(=O)(=O)/C=C/c1ccc(OS(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
ALDH1A1 P00352 2/20 0.43
PPARG P37231 7/20 0.43
NFE2L2 Q16236 3/20 0.43
CXCR2 P25025 2/20 0.41
PTGES2 Q9H7Z7 2/20 0.39
PTPN1 P18031 1/20 0.38
HTT P42858 1/20 0.38
CXCR1 P25024 1/20 0.37
PKM P14618 1/20 0.37
KMT2A Q03164 1/20 0.37

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
SCHEMBL688256 1.00 LMNA (0.43) LMNAALDH1A1PPARGNFE2L2CXCR2
SCHEMBL31051131 0.81 PPARG (0.47) LMNAPPARGNFE2L2CXCR2PTPN1
SCHEMBL688622 0.80 LMNA (0.41) LMNAALDH1A1PPARGNFE2L2PTGES2
SCHEMBL13343069 0.80 LMNA (0.41) LMNAALDH1A1PPARGNFE2L2PTGES2
SCHEMBL688272 0.80 PPARG (0.46) LMNAPPARGNFE2L2CXCR2PTPN1
SCHEMBL687983 0.80 PPARG (0.46) LMNAPPARGNFE2L2CXCR2PTGES2
SCHEMBL688271 0.80 PPARG (0.46) LMNAPPARGNFE2L2CXCR2PTPN1
SCHEMBL687984 0.80 PPARG (0.46) LMNAPPARGNFE2L2CXCR2PTGES2
SCHEMBL687780 0.78 PPARG (0.45) LMNAPPARGNFE2L2CXCR2PTPN1
SCHEMBL687781 0.78 PPARG (0.45) LMNAPPARGNFE2L2CXCR2PTPN1

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
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