SCHEMBL6910514

SCHEMBL6910514

COC(=O)CCOS(=O)(=O)F

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.50
CA12 O43570 6/20 0.47
CA14 Q9ULX7 6/20 0.47
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
CA7 P43166 4/20 0.38
CA9 Q16790 4/20 0.38
LMNA P02545 3/20 0.38
KDM4E B2RXH2 1/20 0.38
CA2 P00918 2/20 0.37
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
HSD17B10 Q99714 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 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
SCHEMBL14654893 0.80 FNTA (0.53) TSHRCA12CA14KMT2AMEN1
SCHEMBL5265771 0.80 TSHR (0.52) TSHRCA12CA14KMT2AMEN1
SCHEMBL9026191 0.78 TSHR (0.44) TSHRCA12CA14KMT2AMEN1
SCHEMBL3265255 0.77 TSHR (0.48) TSHRCA12CA14KMT2AMEN1
SCHEMBL27261915 0.75 TSHR (0.46) TSHRCA12CA14KMT2AMEN1
SCHEMBL11922841 0.73 TSHR (0.55) TSHRCA12CA14KMT2AMEN1
SCHEMBL28473081 0.72 TSHR (0.43) TSHRCA12CA14KMT2AMEN1
SCHEMBL4060095 0.71 TSHR (0.67) TSHRCA12CA14KMT2AMEN1
SCHEMBL29000521 0.71 TSHR (0.67) TSHRCA12CA14KMT2AMEN1
SCHEMBL27522 0.71

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