Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2643875

CCCCC(NN)c1ccc(C(=O)OCC)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 2/20 0.47
DPP7 Q9UHL4 2/20 0.47
LMNA P02545 3/20 0.43
CYP3A4 P08684 3/20 0.43
CYP1A2 P05177 2/20 0.43
MAOA P21397 1/20 0.43
PDK1 Q15118 1/20 0.42
PDK2 Q15119 1/20 0.42
PDK3 Q15120 1/20 0.42
PDK4 Q16654 1/20 0.42
SMN1; SMN2 Q16637 5/20 0.41
ALDH1A1 P00352 4/20 0.41
MAPT P10636 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MEN1 O00255 2/20 0.41
GAA P10253 2/20 0.41
KMT2A Q03164 2/20 0.41
ACHE P22303 1/20 0.41
CA1 P00915 2/20 0.41
CA2 P00918 2/20 0.41

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
SCHEMBL2662131 0.91 LMNA (0.51) LMNACYP3A4CYP1A2MAOASMN1; SMN2
Trifluoroacetic Acid SCHEMBL2643044 0.83 DPP4 (0.50) DPP4DPP7LMNACYP3A4CYP1A2
Trifluoroacetic Acid SCHEMBL27739872 0.83 DPP4 (0.50) DPP4DPP7LMNACYP3A4CYP1A2
Trifluoroacetic Acid SCHEMBL2642916 0.83 DPP4 (0.50) DPP4DPP7LMNACYP3A4CYP1A2
SCHEMBL2643880 0.81 PDK1 (0.40) DPP4DPP7LMNACYP3A4CYP1A2
SCHEMBL2643030 0.80 ESR1 (0.49) LMNACYP3A4CYP1A2MAOASMN1; SMN2
Trifluoroacetic Acid SCHEMBL4699009 0.77 DPP4 (0.46) DPP4DPP7LMNACYP3A4CYP1A2
SCHEMBL2643017 0.74 ESR1 (0.43) LMNACYP3A4CYP1A2MAOAPDK1
Ethyl Benzoate SCHEMBL27530082 0.73 SMN1; SMN2 (0.58) LMNACYP3A4CYP1A2MAOASMN1; SMN2
SCHEMBL11251092 0.72 CASR (0.55) LMNASMN1; SMN2ALDH1A1MAPTKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070088070-A1 Pyrazole derivatives, compositions containing such compounds and methods of use PARMEE EMMA R 2007-04-19 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-20070088070-A1 Pyrazole derivatives, compositions containing such compounds and methods of use PC, GOT2, PNLIP DPP4 13/4885DPP7 14/4885LMNA 1137/4885

“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.