Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL5868041

O=C(CN(C(=O)c1cc2cc(Cl)ccc2[nH]1)c1ccccc1)NCC1CCN(c2ccncc2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.42

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PYGL P06737 5/20 0.42
F10 P00742 13/20 0.41
CNR1 P21554 1/20 0.38
CYP51A1 Q16850 2/20 0.38

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
Trifluoroacetic Acid SCHEMBL5867893 0.86 PYGL (0.44) PYGLCYP51A1
Trifluoroacetic Acid SCHEMBL5868250 0.84 HRH4 (0.43) PYGLCYP51A1
SCHEMBL5868431 0.81 PYGL (0.47) PYGL
Trifluoroacetic Acid SCHEMBL5867994 0.80 KDM4E (0.40) F10
SCHEMBL7254522 0.79 HRH4 (0.47) PYGL
SCHEMBL5868178 0.78 F10 (0.48) F10
Trifluoroacetic Acid SCHEMBL5868319 0.77 F10 (0.53) F10
Trifluoroacetic Acid SCHEMBL5868105 0.77 F10 (0.38) F10
SCHEMBL5868094 0.74 F10 (0.42) F10
SCHEMBL5868163 0.74 PYGL (0.47) PYGL

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-7053078-B2 Serine protease inhibitors ELI LILLY AND COMPANY (US) 2006-05-30 US disclosed
EP-1289954-B1 SERINE PROTEASE INHIBITORS LILLY CO ELI (US) 2005-09-14 EP disclosed
US-6900196-B2 Serine protease inhibitors ELI LILLY AND COMPANY (US) 2005-05-31 US disclosed
US-20040259868-A1 Serine protease inhibitors LIEBESCHUETZ JOHN WALTER (GB) 2004-12-23 US disclosed
US-20030109706-A1 Serine pretease inhibitors ELI LILLY AND COMPANY 2003-06-12 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-20030109706-A1 Serine pretease inhibitors PRSS1, SERPINE1, HPN PYGL 217/4885F10 68/4885CNR1 1737/4885
US-20040259868-A1 Serine protease inhibitors SERPINE1, PRSS1, SERPINB1 PYGL 239/4885F10 60/4885CNR1 1335/4885

“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.