Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3126785

O=C(O)C(F)(F)F.O=C1c2ccccc2C(=O)N1C/C=C1/CCCNC1

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.37
CA9 Q16790 1/20 0.37
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
UHRF1 Q96T88 1/20 0.35
CASP3 P42574 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
ALDH1A1 P00352 2/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KDM4E B2RXH2 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33

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 SCHEMBL3135723 1.00 CA12 (0.37) CA12CA9KMT2AMEN1UHRF1
Trifluoroacetic Acid SCHEMBL3126796 1.00 CA12 (0.37) CA12CA9KMT2AMEN1UHRF1
SCHEMBL13797910 0.89 CASP3 (0.41) CA12CA9KMT2AMEN1CASP3
SCHEMBL30500839 0.89 CASP3 (0.41) CA12CA9KMT2AMEN1CASP3
SCHEMBL13797914 0.89 CASP3 (0.41) CA12CA9KMT2AMEN1CASP3
SCHEMBL20660181 0.89 CASP3 (0.41) CA12CA9KMT2AMEN1CASP3
Trifluoroacetic Acid SCHEMBL3137391 0.77 CA12 (0.43) CA12CA9KMT2AMEN1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL3135731 0.77 CA12 (0.43) CA12CA9KMT2AMEN1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL3135721 0.77 CA12 (0.43) CA12CA9KMT2AMEN1SMN1; SMN2
Trifluoroacetic Acid SCHEMBL3126576 0.76 CA12 (0.42) CA12CA9KMT2AMEN1SMN1; SMN2

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
WO-2010056633-A2 7-AMINO ALKYLIDENYL-HETEROCYCLIC QUINOLONES AND NAPHTHYRIDONES JANSSEN PHARMACEUTICA NV (BE) 2010-05-20 WO disclosed
US-20090156577-A1 7-AMINO ALKYLIDENYL-HETEROCYCLIC QUINOLONES AND NAPHTHYRIDONES JANSSEN PHARMACEUTICA NV (BE) 2009-06-18 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-20090156577-A1 7-AMINO ALKYLIDENYL-HETEROCYCLIC QUINOLONES AND NAPHTHYRIDONES NQO2, QRFPR, NQO1 CA12 3602/4885CA9 1820/4885KMT2A 1652/4885

“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.