Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL1851236

CCS(=O)(=O)O.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.39

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Known targets — ChEMBL curated mechanism

FGFR1FGFR2FGFR3FGFR4FLT1FLT4KDRPDGFRAPDGFRB

The experimentally established mechanism targets of Trifluoromethanesulfonic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
EPHX1 P07099 1/20 0.38
CA1 P00915 2/20 0.35
CA2 P00918 2/20 0.35
CA7 P43166 1/20 0.35
CA13 Q8N1Q1 1/20 0.35
TSHR P16473 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
F2 P00734 2/20 0.31
PRSS1 P07477 2/20 0.31
PRSS2 P07478 2/20 0.31
PRSS3 P35030 2/20 0.31
PTGS1 P23219 1/20 0.30
PDE4A P27815 1/20 0.30
LMNA P02545 1/20 0.30
SLC6A6 P31641 1/20 0.30
CYP2C19 P33261 1/20 0.30
BLM P54132 1/20 0.30
CES1 P23141 5/20 0.30

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 SCHEMBL2285727 0.90 ALDH1A1 (0.41) ALDH1A1L3MBTL1EPHX1CA1CA2
SCHEMBL27493794 0.90 TSHR (0.40) ALDH1A1L3MBTL1EPHX1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL3361058 0.88 EPHX1 (0.43) ALDH1A1L3MBTL1EPHX1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL27669034 0.88 ALDH1A1 (0.39) ALDH1A1L3MBTL1EPHX1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL27910342 0.88 ALDH1A1 (0.39) ALDH1A1L3MBTL1EPHX1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL12506224 0.85 CA1 (0.40) ALDH1A1L3MBTL1EPHX1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL2958868 0.85 EPHX1 (0.41) ALDH1A1L3MBTL1EPHX1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL29171770 0.85 ALDH1A1 (0.38) ALDH1A1L3MBTL1EPHX1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL15667317 0.85 ALDH1A1 (0.38) ALDH1A1L3MBTL1EPHX1CA1CA2
Trifluoromethanesulfonic Acid SCHEMBL28112194 0.85 ALDH1A1 (0.38) ALDH1A1L3MBTL1EPHX1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1433785-A1 Agents for the coloration of keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 EP claimed
EP-3172214-B1 2-AMINO-PYRIDO[2,3-D]PYRIMIDIN-7(8H)-ONE DERIVATIVES AS CDK INHIBITORS AND USES THEREOF SUNSHINE LAKE PHARMA CO LTD (CN) 2020-05-13 EP disclosed
EP-3169671-B1 1-(5-(TERT.-BUTYL)ISOXAZOL-3-YL)-3-(4-((PHENYL)ETHYNYL)PHENYL)UREA DERIVATIVES AND RELATED COMPOUNDS AS FLT3 INHIBITORS FOR TREATING CANCER SUNSHINE LAKE PHARMA CO LTD (CN) 2019-08-21 EP disclosed
EP-2324009-A1 PROCESS FOR PREPARING CERTAIN CINNAMIDE COMPOUNDS Eisai R&D Management Co., Ltd. (JP) 2011-05-25 EP disclosed
WO-2010025197-A1 PROCESS FOR PREPARING CERTAIN CINNAMIDE COMPOUNDS EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-04 WO disclosed
EP-1433785-A1 Agents for the coloration of keratinous fibres Henkel Kommanditgesellschaft auf Aktien (DE) 2004-06-30 EP disclosed