Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL1946833

Cc1ccc(N2CCOC(C(O)C(=O)Nc3ccc4nc(N)[nH]c4c3)C2=O)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F9 P00740 14/20 0.60
ALDH1A1 P00352 1/20 0.36
FLT3 P36888 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.34
ACP1 P24666 1/20 0.34
F11 P03951 1/20 0.34
F7 P08709 1/20 0.34

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
SCHEMBL1946970 0.94 F9 (0.66) F9ALDH1A1
SCHEMBL12569431 0.88 F9 (0.66) F9ALDH1A1
SCHEMBL1946835 0.87 F9 (0.49) F9ALDH1A1FLT3F11F7
Trifluoroacetic Acid SCHEMBL1438252 0.82 F9 (0.89) F9
Trifluoroacetic Acid SCHEMBL1948933 0.81 F9 (0.67) F9L3MBTL1
Trifluoroacetic Acid SCHEMBL1948291 0.80 F9 (0.88) F9
SCHEMBL12545651 0.79 F9 (0.72) F9
SCHEMBL1947401 0.79 F9 (0.67) F9ALDH1A1
SCHEMBL1946542 0.77 F9 (0.67) F9
SCHEMBL1950493 0.75 F9 (1.00) F9

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
EP-2373634-B1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MOCHIDA PHARM CO LTD (JP) 2015-11-11 EP disclosed
US-8987242-B2 Morpholinone compounds as factor IXA inhibitors MERCK SHARP & DOHME CORP. (US) 2015-03-24 US disclosed
US-8642582-B2 Morpholinone compounds as factor IXa inhibitors MERCK SHARP & DOHME CORP. (US) 2014-02-04 US disclosed
US-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-06-09 US disclosed
US-20110059958-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS MERCK SHARP & DOHME LLC 2011-03-10 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-20110135650-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS SERPINC1, F9, F8 F9 2/4885ALDH1A1 2444/4885FLT3 1068/4885
US-20110059958-A1 MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS SERPINC1, F9, F8 F9 2/4885ALDH1A1 2444/4885FLT3 1068/4885

“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.