Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL2848643

CCOc1cccc(C(Nc2cc(F)c3c(N)nccc3c2)C(=O)NCc2cc(NC(C)=O)ccc2S(=O)(=O)CC)c1.O=C(O)C(F)(F)F

nearest known ligand 0.58

Full drug profile on Sugi Atlas →

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
F7 P08709 20/20 0.58
F3 P13726 20/20 0.58
F10 P00742 15/20 0.58
F2 P00734 14/20 0.58
F11 P03951 12/20 0.58
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36

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
SCHEMBL14009075 0.96 F7 (0.61) F7F3F10F2F11
Trifluoroacetic Acid SCHEMBL2854587 0.91 F7 (0.70) F7F3F10F2F11
Trifluoroacetic Acid SCHEMBL2859517 0.90 F7 (0.45) F7F3F10F2F11
SCHEMBL8254296 0.88 F7 (0.51) F7F3F10F2F11
Trifluoroacetic Acid SCHEMBL5003791 0.86 F7 (0.49) F7F3F10F2F11
SCHEMBL8251888 0.86 F7 (0.76) F7F3F10F2F11
Trifluoroacetic Acid SCHEMBL2851036 0.85 F7 (0.66) F7F3F10F2F11
SCHEMBL14009073 0.85 F7 (0.48) F7F3F10F2F11
SCHEMBL13513350 0.85 F7 (0.48) F7F3F10F2F11
Trifluoroacetic Acid SCHEMBL5003874 0.85 F7 (0.70) F7F3F10F2F11

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-1910298-B1 PHENYLGLYCINAMIDE AND PYRIDYLGLYCINAMIDE DERIVATIVES USEFUL AS ANTICOAGULANTS BRISTOL MYERS SQUIBB CO (US) 2010-01-13 EP disclosed
US-7456195-B2 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2008-11-25 US disclosed
US-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants BRISTOL-MYERS SQUIBB COMPANY (US) 2007-01-04 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-20070003539-A1 Phenylglycinamide and pyridylglycinamide derivatives useful as anticoagulants F12, F11, F7 F7 3/4885F3 10/4885F10 19/4885

“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.