Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2205337

O=C(O)C(F)(F)F.O=C(c1ccc(C(=O)C(F)(F)F)s1)N1CCN(c2ccccc2)CC1Cc1ccccc1

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 9/20 0.44
CYP2C9 P11712 2/20 0.44
NR1H2 P55055 3/20 0.43
NR1H3 Q13133 3/20 0.43
HDAC1 Q13547 7/20 0.42
HDAC4 P56524 7/20 0.42
HDAC3 O15379 6/20 0.42
MAPT P10636 1/20 0.40
CA1 P00915 6/20 0.38
CA2 P00918 6/20 0.38
CA4 P22748 6/20 0.38
CA9 Q16790 6/20 0.38
ABCB1 P08183 1/20 0.38

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
SCHEMBL17707648 0.98 HDAC6 (0.45) HDAC6CYP2C9NR1H2NR1H3HDAC1
SCHEMBL2202464 0.72 CYP2C9 (0.62) HDAC6CYP2C9HDAC1HDAC3CA1
SCHEMBL2205341 0.72 HDAC6 (0.39) HDAC6CYP2C9HDAC1HDAC4HDAC3
Trifluoroacetic Acid SCHEMBL2204740 0.71 HDAC6 (0.44) HDAC6CYP2C9HDAC1HDAC4HDAC3
Trifluoroacetic Acid SCHEMBL2201998 0.71 HSP90AA1 (0.48) HDAC6CYP2C9HDAC1HDAC4HDAC3
Trifluoroacetic Acid SCHEMBL2201899 0.69 F10 (0.50) HDAC6HDAC1HDAC4HDAC3
SCHEMBL17707665 0.69 HDAC6 (0.46) HDAC6CYP2C9HDAC1HDAC4HDAC3
Trifluoroacetic Acid SCHEMBL2204680 0.69 HDAC6 (0.60) HDAC6CYP2C9HDAC1HDAC4HDAC3
SCHEMBL17707632 0.68 HSP90AA1 (0.50) HDAC6CYP2C9HDAC1HDAC4HDAC3
Trifluoroacetic Acid SCHEMBL2206269 0.68 HDAC6 (0.48) HDAC6CYP2C9HDAC1HDAC4HDAC3

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
EP-1926721-B1 THIOPHENE AND THIAZOLE SUBSTITUTED TRIFLUOROETHANONE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS MSD ITALIA SRL (IT) 2016-05-04 EP claimed
EP-1926721-B1 THIOPHENE AND THIAZOLE SUBSTITUTED TRIFLUOROETHANONE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS MSD ITALIA SRL (IT) 2016-05-04 EP disclosed
US-7977374-B2 Thiophene and thiazole substituted trifluoroethanone derivatives as histone deacetylase (HDAC) inhibitors ISTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-07-12 US disclosed
US-20090156591-A1 Thiophene and Thiazole Substituted trifluoroethanone Derivatives as Histone Deacetylase (Hdac) Inhibitors MSD ITALIA S.R.L. (IT) 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-20090156591-A1 Thiophene and Thiazole Substituted trifluoroethanone Derivatives as Histone Deacetylase (Hdac) Inhibitors HDAC1, HDAC2, HDAC11 HDAC6 6/4885CYP2C9 2067/4885NR1H2 745/4885

“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.