Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL8736573

Cc1cccc(-c2ccccc2I)c1.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.43

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN5 P54829 2/20 0.43
PDK2 Q15119 1/20 0.43
NPC1 O15118 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.42
NFKB1 P19838 1/20 0.42
RAB9A P51151 1/20 0.42
NFKB2 Q00653 1/20 0.42
RELA Q04206 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SDHB P21912 1/20 0.41
PTPN1 P18031 2/20 0.39
CNR2 P34972 2/20 0.39
CNR1 P21554 1/20 0.39
ENPP1 P22413 1/20 0.39
GPR3 P46089 1/20 0.38
KCNH2 Q12809 1/20 0.38
SLC9A1 P19634 1/20 0.37
AKR1C3 P42330 1/20 0.36
AKR1C2 P52895 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
Trifluoromethanesulfonic Acid SCHEMBL8737223 0.84 POLB (0.40) PTPN5PDK2NPC1ALDH1A1MAPT
Trifluoromethanesulfonic Acid SCHEMBL30131111 0.83 PTPN1 (0.42) PTPN5ALDH1A1PTPN1GPR3PTGS2
Trifluoromethanesulfonic Acid SCHEMBL4660340 0.83 PTPN1 (0.42) PTPN5ALDH1A1PTPN1GPR3PTGS2
SCHEMBL18574523 0.83 RAB9A (0.46) PDK2NPC1ALDH1A1MAPTNFKB1
SCHEMBL11274302 0.82 MAPT (0.43) NPC1ALDH1A1MAPTNFKB1RAB9A
SCHEMBL21730833 0.80 ENPP3 (0.44) PTPN5PDK2NPC1ALDH1A1MAPT
Trifluoromethanesulfonic Acid SCHEMBL8735155 0.77 PTPN1 (0.37) PTPN5ALDH1A1PTPN1GPR3KCNH2
Trifluoromethanesulfonic Acid SCHEMBL3347591 0.77 ACHE (0.38) PTPN5SMN1; SMN2SDHBPTPN1GPR3
Trifluoromethanesulfonic Acid SCHEMBL8735167 0.77 TRPA1 (0.39) PDK2NPC1ALDH1A1RAB9ASDHB
SCHEMBL21149109 0.76 ENPP3 (0.44) PDK2NPC1ALDH1A1MAPTNFKB1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697387-B1 Improved method for the preparation of iodonium salts DOW CORNING (US) 1998-04-22 EP disclosed