Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2073501

CC(=O)CCCCC[C@H](NC(=O)Cc1c[nH]c2ccc(Cl)cc12)c1ncc(-c2ccccc2)[nH]1.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 19/20 0.57
HDAC3 O15379 5/20 0.57
HDAC2 Q92769 3/20 0.57
HDAC4 P56524 1/20 0.57
HDAC6 Q9UBN7 1/20 0.57
SSTR1 P30872 1/20 0.51
SSTR3 P32745 1/20 0.51
NR1I2 O75469 1/20 0.48
CYP2C9 P11712 1/20 0.48
HDAC8 Q9BY41 1/20 0.48

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
SCHEMBL15513177 0.96 HDAC1 (0.62) HDAC1HDAC3HDAC2HDAC4HDAC6
Trifluoroacetic Acid SCHEMBL2070991 0.92 HDAC1 (0.58) HDAC1HDAC3HDAC2HDAC4HDAC6
Trifluoroacetic Acid SCHEMBL2070841 0.92 HDAC1 (0.58) HDAC1HDAC3HDAC2HDAC4HDAC6
Trifluoroacetic Acid SCHEMBL2071703 0.92 HDAC1 (0.57) HDAC1HDAC3HDAC2HDAC4HDAC6
Trifluoroacetic Acid SCHEMBL2071490 0.91 HDAC1 (0.58) HDAC1HDAC3HDAC2HDAC4HDAC6
Trifluoroacetic Acid SCHEMBL2074874 0.91 HDAC1 (0.70) HDAC1HDAC3HDAC2HDAC4HDAC6
Trifluoroacetic Acid SCHEMBL2073164 0.90 HDAC1 (0.60) HDAC1HDAC3HDAC2HDAC4HDAC6
SCHEMBL15513297 0.88 HDAC1 (0.62) HDAC1HDAC3HDAC2HDAC4HDAC6
Trifluoroacetic Acid SCHEMBL2074374 0.88 HDAC1 (0.56) HDAC1HDAC3HDAC2HDAC4HDAC6
SCHEMBL15512872 0.88 HDAC1 (0.62) HDAC1HDAC3HDAC2HDAC4HDAC6

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-1828171-B1 HETEROCYCLE DERIVATIVES AS HISTONE DEACETYLASE (HDAC) INHIBITORS ANGELETTI P IST RICHERCHE BIO (IT) 2014-03-12 EP disclosed
US-7863294-B2 Heterocycle derivatives as histone deacetylase (HDAC) inhibitors INSTITUTO DI RICERCHE DI BIOLOGIA MOLECOLARE P. ANGELETTI SPA (IT) 2011-01-04 US disclosed
US-20090048228-A1 Heterocycle Derivatives As Histone Deacetylase (Hdac) Inhibitors MSD ITALIA S.R.L. (IT) 2009-02-19 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-20090048228-A1 Heterocycle Derivatives As Histone Deacetylase (Hdac) Inhibitors HDAC1, HDAC5, HDAC11 HDAC1 1/4885HDAC3 7/4885HDAC2 10/4885

“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.