Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL907503

CC(C)OC[N+]1(C)CCCC1.O=C([O-])C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36
BBOX1 O75936 2/20 0.32
HTT P42858 1/20 0.30
APOBEC3A P31941 2/20 0.30
APOBEC3G Q9HC16 2/20 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
Trifluoroacetic Acid SCHEMBL907638 0.83
Trifluoroacetic Acid SCHEMBL907742 0.83
Trifluoroacetic Acid SCHEMBL907854 0.81 KDM4E (0.36) CYP3A4TSHRTDP1LMNABLM
Trifluoroacetic Acid SCHEMBL907760 0.81 CHRM2 (0.30)
SCHEMBL5484951 0.80 KDM4E (0.37) BBOX1
Trifluoroacetic Acid SCHEMBL907379 0.80
Trifluoroacetic Acid SCHEMBL907566 0.79
Trifluoroacetic Acid SCHEMBL907308 0.79 LMNA (0.33) CYP3A4TSHRTDP1LMNABLM
Nitrous Acid SCHEMBL3446912 0.78 KDM4E (0.31) CYP3A4TSHRTDP1LMNABLM
SCHEMBL3448541 0.78 KDM4E (0.31) CYP3A4TSHRTDP1LMNABLM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7875732-B2 Quaternary ammonium salt, electrolyte, electrolyte, solution and electrochemical device OTSUKA CHEMICAL CO., LTD. (JP) 2011-01-25 US disclosed
US-20080050657-A1 N-methoxymethyl-N-methylpyrrolidinium trifluoromethanesulfonate; high solubility in organic solvents, high electroconductivity, voltage resistance; environmentally friendly; use in lithium battery; double layer capacitors STELLA CHEMIFA CORPORATION (JP) 2008-02-28 US disclosed
EP-1837333-A1 QUATERNARY AMMONIUM SALT, ELECTROLYTE, ELECTROLYTE SOLUTION AND ELECTROCHEMICAL DEVICE Otsuka Chemical Co., Ltd. (JP) 2007-09-26 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080050657-A1 N-methoxymethyl-N-methylpyrrolidinium trifluoromethanesulfonate; high solubility in organic solvents, high electroconductivity, voltage resistance; environmentally friendly; use in lithium battery; double layer capacitors CACNA1F, KCNN2, KCNN3 CYP3A4 1500/4885TSHR 3740/4885TDP1 4006/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.