Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4489690

Cc1cc(NCc2ccc(F)cc2F)c(Cl)c(=O)n1Cc1ccc(C#N)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.52

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 11/20 0.52
RXRA P19793 1/20 0.42
NR1H2 P55055 1/20 0.42
NR1H3 Q13133 1/20 0.42
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HSD17B10 Q99714 1/20 0.42
GPR6 P46095 2/20 0.41
FNTA P49354 2/20 0.40
FNTB P49356 2/20 0.40
KLKB1 P03952 1/20 0.38
KLK1 P06870 1/20 0.38
VNN1 O95497 1/20 0.38
PPARG P37231 1/20 0.37

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
SCHEMBL4380849 0.93 MAPK14 (0.58) MAPK14RXRANR1H2NR1H3KDM4E
Trifluoroacetic Acid SCHEMBL3527236 0.85 MAPK14 (0.45) MAPK14RXRANR1H2NR1H3GPR6
SCHEMBL29594334 0.84 MAPK14 (0.59) MAPK14KDM4EALDH1A1HSD17B10KLKB1
SCHEMBL4387481 0.84 MAPK14 (0.59) MAPK14KDM4EALDH1A1HSD17B10KLKB1
SCHEMBL3523258 0.77 MAPK14 (0.50) MAPK14RXRANR1H2NR1H3KDM4E
SCHEMBL3522226 0.69 MAPK14 (0.51) MAPK14KDM4EALDH1A1HSD17B10FNTA
SCHEMBL4377123 0.69 MAPK14 (0.51) MAPK14
SCHEMBL4374522 0.69 MAPK14 (0.63) MAPK14ALDH1A1
SCHEMBL4376488 0.69 MAPK14 (1.00) MAPK14
SCHEMBL29593468 0.69 MAPK14 (1.00) MAPK14

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 US claimed
US-7629363-B2 antiinflammatory agent for treating asthma and chronic pulmonary inflammatory disease PFIZER INC (US) 2009-12-08 US disclosed
US-7067540-B2 Substituted pyridinones PHARMACIA CORPORATION (US) 2006-06-27 US disclosed
US-20050176775-A1 Substituted pyridinones PHARMACIA CORPORATION 2005-08-11 US disclosed
US-20040058964-A1 Substituted pyridinones PHARMACIA LLC 2004-03-25 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 (2 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-20040058964-A1 Substituted pyridinones MAPK1, MAPK6, MAPK7 MAPK14 41/4885RXRA 897/4885NR1H2 575/4885
US-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 MAPK14 53/4885RXRA 843/4885NR1H2 878/4885

“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.