Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3470280

NCCN1CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.41
PKM P14618 1/20 0.37
CHRM2 P08172 3/20 0.36
CHRM4 P08173 3/20 0.36
CHRM1 P11229 3/20 0.36
CHRM5 P08912 2/20 0.36
CHRM3 P20309 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
HSD17B10 Q99714 1/20 0.36
SLC2A1 P11166 1/20 0.36
ANPEP P15144 1/20 0.36
ERAP2 Q6P179 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
CXCR4 P61073 2/20 0.35
SIGMAR1 Q99720 2/20 0.35
HRH4 Q9H3N8 1/20 0.34

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 SCHEMBL1401787 0.87 PKM (0.38) PKMCHRM2CHRM4CHRM1CHRM5
Trifluoroacetic Acid SCHEMBL1401786 0.87 PKM (0.38) PKMCHRM2CHRM4CHRM1CHRM5
Bicarbonate SCHEMBL16668577 0.87 ALOX15 (0.50) ALOX15CHRM2CHRM4CHRM1CHRM5
Carbamic Acid SCHEMBL10977422 0.85 ALOX15 (0.48) ALOX15CHRM2CHRM4CHRM1CHRM5
SCHEMBL26631955 0.84 SIGMAR1 (0.41) ALOX15CHRM2CHRM4CHRM1CHRM5
Acetic Acid SCHEMBL10762264 0.83 ALOX15 (0.46) ALOX15CHRM5CHRM3KDM4EALDH1A1
Glycine SCHEMBL21810684 0.83 ALOX15 (0.46) ALOX15CHRM2CHRM4CHRM1CHRM5
Trifluoroacetic Acid SCHEMBL6476259 0.83 CXCR4 (0.43) PKMCHRM2CHRM4CHRM1CHRM5
Trifluoroacetic Acid SCHEMBL22123107 0.82 KDM4E (0.39) PKMCHRM2CHRM4CHRM1CHRM5
Trifluoroacetic Acid SCHEMBL8438777 0.81 CXCR4 (0.47) PKMCHRM2CHRM4CHRM1CHRM5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-101935311-B Piperazinium trifluoroacetate compound and carbon dioxide absorbent using the same HYUNDAI MOTOR CO LTD 2015-06-10 CN disclosed
US-8287627-B2 Piperazinium trifluoroacetate compound and carbon dioxide absorbent using the same HYUNDAI MOTOR COMPANY (KR) 2012-10-16 US disclosed
CN-101935311-A Piperazinium trifluoroacetate compound and carbon dioxide absorbent using the same HYUNDAI MOTOR CO LTD 2011-01-05 CN disclosed
US-20100326277-A1 PIPERAZINIUM TRIFLUOROACETATE COMPOUND AND CARBON DIOXIDE ABSORBENT USING THE SAME HYUNDAI MOTOR COMPANY (KR) 2010-12-30 US 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-20100326277-A1 PIPERAZINIUM TRIFLUOROACETATE COMPOUND AND CARBON DIOXIDE ABSORBENT USING THE SAME SLC16A7, SLC16A1, SLC16A3 ALOX15 3491/4885PKM 304/4885CHRM2 1636/4885

“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.