Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4166937

CN(C)CC(=O)N[C@@H](CCCSCC(=O)C(F)(F)F)C(=O)Nc1cc(Cl)cc(Cl)c1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
FABP4 P15090 1/20 0.36
ALDH1A1 P00352 3/20 0.35
GAA P10253 1/20 0.35
CES1 P23141 6/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
FAAH O00519 4/20 0.33
CES2 O00748 2/20 0.33
HDAC1 Q13547 2/20 0.33
PLA2G6 O60733 1/20 0.33
HDAC2 Q92769 1/20 0.33
HDAC4 P56524 1/20 0.32
PPARG P37231 1/20 0.31
PPARA Q07869 1/20 0.31
CCKBR P32239 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL4605614 0.82 CES1 (0.45) FABP4ALDH1A1GAACES1MEN1
SCHEMBL4166940 0.82 ALDH1A1 (0.34) FABP4ALDH1A1GAACES1MEN1
Trifluoroacetic Acid SCHEMBL4156514 0.80 SMN1; SMN2 (0.37) MEN1KMT2AHDAC1HDAC2SMN1; SMN2
SCHEMBL4164039 0.80 HDAC1 (0.41) ALDH1A1GAACES1MEN1KMT2A
SCHEMBL3507605 0.79 GPR139 (0.42) GAAMEN1KMT2AHDAC1HDAC2
Trifluoroacetic Acid SCHEMBL4158022 0.78 HDAC1 (0.38) CES1HDAC1HDAC2SMN1; SMN2
Trifluoroacetic Acid SCHEMBL4169533 0.78 MAPT (0.41) ALDH1A1MEN1KMT2AMAPT
SCHEMBL4606348 0.78 POLB (0.39) FABP4CES1MEN1KMT2AHDAC1
SCHEMBL4156708 0.76 CCKBR (0.34) CES1MEN1KMT2AHDAC1HDAC2
SCHEMBL4159631 0.75 HDAC4 (0.47) ALDH1A1MEN1KMT2AHDAC1HDAC2

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-20090054448-A1 Amino Acid Derivatives as Histone Deacetylase (HDAC) Inhibitors JONES PHILIP 2009-02-26 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-20090054448-A1 Amino Acid Derivatives as Histone Deacetylase (HDAC) Inhibitors HDAC5, HDAC1, HDAC11 FABP4 2679/4885ALDH1A1 320/4885GAA 503/4885

“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.