Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL7708688

CC(C)(C)c1ccc([S+](c2ccc(C(C)(C)C)cc2)c2ccc(C(C)(C)C)cc2)cc1.O=S(=O)(O)C(F)(F)F.O=S(=O)([O-])C(F)(F)F.Sc1ccccc1

nearest known ligand 0.36

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Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 7/20 0.36
HSD17B2 P37059 2/20 0.36
HSD17B3 P37058 1/20 0.36
UQCRB P14927 1/20 0.36
ALDH1A1 P00352 4/20 0.34
NPC1 O15118 1/20 0.34
RECQL P46063 1/20 0.34
RAB9A P51151 1/20 0.34
GPR3 P46089 1/20 0.33
MAPT P10636 2/20 0.33
KEAP1 Q14145 1/20 0.33
NFE2L2 Q16236 1/20 0.33
RORA P35398 1/20 0.33
PSD A5PKW4 1/20 0.32
TDP1 Q9NUW8 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
EEF2K O00418 1/20 0.31
GAA P10253 1/20 0.31

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
Trifluoromethanesulfonic Acid SCHEMBL3136704 0.86 HSD11B1 (0.41) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL51512 0.86 HSD11B1 (0.41) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL36543 0.83 ALDH1A1 (0.46) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1
SCHEMBL2437122 0.82 HSD11B1 (0.40) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1
SCHEMBL2437602 0.81 HSD11B1 (0.40) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1
Trifluoromethanesulfonic Acid SCHEMBL3249775 0.80 GPR3 (0.44) HSD11B1GPR3
SCHEMBL1477345 0.79 ALDH1A1 (0.40) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1
Biphenyl SCHEMBL1992773 0.79 PTPN1 (0.45) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1
SCHEMBL29745785 0.79 HSD11B1 (0.40) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1
SCHEMBL2286473 0.79 ALDH1A1 (0.40) HSD11B1HSD17B2HSD17B3UQCRBALDH1A1

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
US-6358665-B1 ONIUM SALT PRECURSOR FOR GENERATING FLUOROALKYLSULFONATE CLARIANT INTERNATIONAL LTD. (CH) 2002-03-19 US disclosed
EP-1033624-A1 RADIATION-SENSITIVE COMPOSITION OF CHEMICAL AMPLIFICATION TYPE Clariant International Ltd. (CH) 2000-09-06 EP disclosed