SCHEMBL6903829

SCHEMBL6903829

CN(C)S(=O)(=O)OC(CCc1ccccc1)C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.49
PPARA Q07869 6/20 0.49
BLM P54132 1/20 0.43
ACE P12821 2/20 0.41
TSHR P16473 1/20 0.41
SRR Q9GZT4 2/20 0.41
PTGES O14684 1/20 0.40
ALOX5 P09917 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
SCHEMBL6171187 0.83 PPARG (0.52) PPARGPPARABLMACETSHR
SCHEMBL6171190 0.83 PPARG (0.52) PPARGPPARABLMACETSHR
SCHEMBL6903818 0.80 PPARG (0.52) PPARGPPARABLMACESRR
SCHEMBL18063399 0.80 BLM (0.61) PPARGPPARABLMSRR
SCHEMBL6907074 0.79 PPARG (0.49) PPARGPPARABLMACETSHR
SCHEMBL7495011 0.79 PPARG (0.61) PPARGPPARAACETSHRSRR
SCHEMBL6515182 0.78 PPARG (0.50) PPARGPPARABLMSRR
SCHEMBL7425913 0.78 PPARG (0.50) PPARGPPARABLMSRR
SCHEMBL605143 0.76 ALDH1A1 (0.51) PPARGPPARABLM
SCHEMBL2729126 0.76 PPARG (0.58) PPARGPPARAACETSHRSRR

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-1075463-B1 CONVERSION OF A HYDROXY GROUP IN CERTAIN ALCOHOLS INTO A FLUOROSULFONATE ESTER OR A TRIFLUOROMETHYLSULFONATE ESTER LOEWENTHAL HANS JACOB EDGAR (IL) 2004-06-16 EP disclosed
US-6395918-B1 Conversion of a hydroxy group in certain alcohols into a fluorosulfonate ester or a trifluoromethylsulfonate ester LOEWENTHAL HANS JACOB EDGAR (IL) 2002-05-28 US disclosed