Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2828565

COc1ccc2c(c1)N(Cc1ccc(COc3ccc(CCC(=O)O)cc3)cc1)CCCC2.O=C(O)C(F)(F)F

nearest known ligand 0.57

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 3/20 0.57
HDAC6 Q9UBN7 3/20 0.57
FFAR1 O14842 11/20 0.53
RXRA P19793 1/20 0.53
RXRB P28702 1/20 0.53
RXRG P48443 1/20 0.53
HRH3 Q9Y5N1 5/20 0.47
FFAR4 Q5NUL3 3/20 0.44

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
SCHEMBL13887168 0.95 HDAC1 (0.62) HDAC1HDAC6FFAR1RXRARXRB
SCHEMBL2828567 0.89 HDAC1 (0.54) HDAC1HDAC6FFAR1RXRARXRB
Trifluoroacetic Acid SCHEMBL2827678 0.85 FFAR1 (0.53) HDAC1HDAC6FFAR1RXRARXRB
SCHEMBL13065062 0.80 FFAR1 (0.58) HDAC1HDAC6FFAR1RXRARXRB
SCHEMBL13312212 0.76 RXRG (0.55) HDAC1HDAC6FFAR1RXRARXRB
Trifluoroacetic Acid SCHEMBL2825240 0.76 HDAC1 (0.52) HDAC1HDAC6FFAR1RXRARXRB
SCHEMBL2827682 0.74 HDAC1 (0.47) HDAC1HDAC6FFAR1RXRARXRB
SCHEMBL13312076 0.74 FFAR1 (0.54) FFAR1RXRARXRBRXRGHRH3
SCHEMBL23950268 0.73 HDAC1 (1.00) HDAC1HDAC6
SCHEMBL30053304 0.73 HDAC1 (1.00) HDAC1HDAC6

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-1731505-B1 ALKOXYPHENYLPROPANOIC ACID DERIVATIVES TAKEDA PHARMACEUTICAL (JP) 2015-01-14 EP disclosed
EP-2253315-A1 Alkoxyphenylpropanoic acid derivatives Takeda Pharmaceutical Company Limited (JP) 2010-11-24 EP disclosed
US-7517910-B2 Alkoxyphenylpropanoic acid derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-04-14 US disclosed
US-20070213364-A1 Alkoxyphenylpropanoic Acid Derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2007-09-13 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-20070213364-A1 Alkoxyphenylpropanoic Acid Derivatives GPR119, FFAR1, GPR55 HDAC1 2167/4885HDAC6 2789/4885FFAR1 2/4885

“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.