Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3523604

Cc1ncc(Cn2c(C)nc(OCc3c(F)cc(F)cc3F)c(Br)c2=O)c(N)n1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
TKT P29401 2/20 0.36
LMNA P02545 1/20 0.35
MAPK14 Q16539 9/20 0.34
CGAS Q8N884 1/20 0.34
ALOX5AP P20292 4/20 0.32

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
SCHEMBL5263788 0.94 LMNA (0.39) TKTLMNAMAPK14CGAS
Trifluoroacetic Acid SCHEMBL3524114 0.90 MAPK14 (0.46) MAPK14
Trifluoroacetic Acid SCHEMBL4376502 0.86 MAPK14 (0.49) MAPK14
SCHEMBL5264452 0.83 MAPK14 (0.49) MAPK14
Hydrochloric Acid SCHEMBL3525346 0.82 MAPK14 (0.48) MAPK14
Trifluoroacetic Acid SCHEMBL3522531 0.80 MAPK14 (0.42) MAPK14
Trifluoroacetic Acid SCHEMBL3523346 0.80 MAPK14 (0.42) MAPK14
SCHEMBL13603026 0.79 MAPK14 (0.52) MAPK14
Trifluoroacetic Acid SCHEMBL3523591 0.78 MAPK14 (0.42) MAPK14
Trifluoroacetic Acid SCHEMBL3523588 0.78 MAPK14 (0.43) 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-7795271-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2010-09-14 US disclosed
US-20090306108-A1 SUBSTITUTED PYRIMIDINONES PFIZER INC 2009-12-10 US disclosed
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES PHARMACIA CORPORATION (US) 2007-07-19 US disclosed
US-7183287-B2 Substituted pyrimidinones PHARMACIA CORPORATION (US) 2007-02-27 US disclosed
US-20040242608-A1 Substituted pyrimidinones PHARMACIA LLC 2004-12-02 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 (3 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-20090306108-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 TKT 1473/4885LMNA 3164/4885MAPK14 38/4885
US-20040242608-A1 Substituted pyrimidinones MAPK1, MAPK7, MAP3K8 TKT 1592/4885LMNA 3198/4885MAPK14 29/4885
US-20070167621-A1 SUBSTITUTED PYRIMIDINONES MAPK1, MAP3K8, MAP3K7 TKT 1473/4885LMNA 3164/4885MAPK14 38/4885

“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.