Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4160784

Cc1nc2ccccn2c1CN(C)C(=O)c1ccc(C(=O)C(F)(F)F)s1.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC4 P56524 6/20 0.57
HDAC6 Q9UBN7 6/20 0.57
HDAC3 O15379 4/20 0.57
HDAC1 Q13547 3/20 0.57
ALDH1A1 P00352 7/20 0.47
TUBB4A P04350 1/20 0.46
TUBB P07437 1/20 0.46
TUBA3C P0DPH7 1/20 0.46
TUBA1B P68363 1/20 0.46
TUBA4A P68366 1/20 0.46
TUBB4B P68371 1/20 0.46
TUBB3 Q13509 1/20 0.46
TUBB2A Q13885 1/20 0.46
TUBB8 Q3ZCM7 1/20 0.46
TUBA3E Q6PEY2 1/20 0.46
TUBA1A Q71U36 1/20 0.46
HDAC7 Q8WUI4 1/20 0.46
HDAC2 Q92769 1/20 0.46
HDAC10 Q969S8 1/20 0.46
HDAC11 Q96DB2 1/20 0.46

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
SCHEMBL17707560 0.78 HDAC1 (0.55) HDAC4HDAC6HDAC3HDAC1ALDH1A1
SCHEMBL2205037 0.74 HDAC6 (1.00) HDAC4HDAC6HDAC3HDAC1TUBB4A
Trifluoroacetic Acid SCHEMBL2203255 0.74 HDAC6 (0.58) HDAC4HDAC6HDAC3HDAC1TUBB4A
SCHEMBL4160790 0.73 HDAC6 (0.52) HDAC4HDAC6HDAC3HDAC1TUBB4A
Trifluoroacetic Acid SCHEMBL2203429 0.71 HDAC6 (0.60) HDAC4HDAC6HDAC3HDAC1TUBB4A
Trifluoroacetic Acid SCHEMBL2199699 0.71 HDAC6 (0.60) HDAC4HDAC6HDAC3HDAC1TUBB4A
Trifluoroacetic Acid SCHEMBL2199819 0.71 HDAC6 (0.64) HDAC4HDAC6HDAC3HDAC1TUBB4A
Trifluoroacetic Acid SCHEMBL2202036 0.71 HDAC6 (0.59) HDAC4HDAC6HDAC3HDAC1ALDH1A1
Trifluoroacetic Acid SCHEMBL2202214 0.70 HDAC6 (0.61) HDAC4HDAC6HDAC3HDAC1TUBB4A
SCHEMBL17707652 0.70 HDAC6 (0.58) HDAC4HDAC6HDAC3HDAC1TUBB4A

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 3 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-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 HDAC4 4/4885HDAC6 6/4885HDAC3 9/4885

“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.