Trifluoromethanesulfonic Acid

Trifluoromethanesulfonic Acid

SCHEMBL28355288

CC(N)c1ccccc1.O=S(=O)(O)C(F)(F)F

nearest known ligand 0.59

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.42
KDM4E B2RXH2 2/20 0.42
ADRA2A P08913 1/20 0.42
ADRA2C P18825 1/20 0.42
HIF1A Q16665 1/20 0.42
ALDH1A1 P00352 3/20 0.42
GMNN O75496 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
HPGD P15428 1/20 0.42
PMP22 Q01453 1/20 0.42
KMT2A Q03164 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
PDE2A O00408 1/20 0.42
SRC P12931 1/20 0.40
CTRB1 P17538 2/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA5A P35218 1/20 0.37

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
Sulfuric Acid SCHEMBL4454713 0.86 ALDH1A1 (0.53) LMNAKDM4EADRA2AADRA2CHIF1A
Sulfuric Acid SCHEMBL28277238 0.86 ALDH1A1 (0.53) LMNAKDM4EADRA2AADRA2CHIF1A
SCHEMBL28480610 0.84 ALDH1A1 (0.52) LMNAKDM4EADRA2AADRA2CHIF1A
Phenyl Ethanol SCHEMBL28419508 0.83 NR1I2 (0.49) LMNAKDM4EADRA2AADRA2CHIF1A
SCHEMBL4281764 0.82 LMNA (0.45) LMNAKDM4EADRA2AADRA2CHIF1A
Sulfuric Acid SCHEMBL4454716 0.81 LMNA (0.45) LMNAKDM4EADRA2AADRA2CHIF1A
Phenylglycine SCHEMBL9302767 0.80 SRC (0.47) LMNAALDH1A1KMT2ATDP1SRC
Bicarbonate SCHEMBL27964415 0.78 LMNA (0.54) LMNAKDM4EADRA2AADRA2CHIF1A
Trifluoromethanesulfonic Acid SCHEMBL8215497 0.77 SRC (0.44) LMNASRC
Methyl Alcohol SCHEMBL5316422 0.77 ADRA2A (0.58) LMNAKDM4EADRA2AADRA2CHIF1A

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
CN-110683975-B Synthesis method of dialkyl amino alkyl dithioformate 成都理工大学 2021-04-09 CN disclosed
CN-110683975-A Synthesis method of dialkyl amino alkyl dithioformate 成都理工大学 2020-01-14 CN disclosed