Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3163797

O=C(Nc1ccc(Cl)cn1)c1ccccc1NC(=O)c1ccc(Cl)cc1OC1CCNCC1.O=C(O)C(F)(F)F

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 2/20 0.50
F10 P00742 17/20 0.49
IRAK1 P51617 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
TDP1 Q9NUW8 1/20 0.45

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 SCHEMBL3156028 0.94 F10 (0.47) IRAK4F10IRAK1SMN1; SMN2TDP1
Trifluoroacetic Acid SCHEMBL3151400 0.94 F10 (0.48) IRAK4F10
SCHEMBL8267448 0.94 IRAK4 (0.55) IRAK4F10IRAK1
Trifluoroacetic Acid SCHEMBL3166311 0.91 F10 (0.47) IRAK4F10IRAK1
SCHEMBL8265127 0.89 F10 (0.51) IRAK4F10IRAK1SMN1; SMN2TDP1
Trifluoroacetic Acid SCHEMBL5201128 0.88 F10 (0.44) IRAK4F10IRAK1
Trifluoroacetic Acid SCHEMBL3903764 0.88 IRAK4 (0.49) IRAK4F10IRAK1SMN1; SMN2TDP1
SCHEMBL8265838 0.88 F10 (0.53) IRAK4F10IRAK1
SCHEMBL3160888 0.87 F10 (0.51) IRAK4F10
Trifluoroacetic Acid SCHEMBL3165919 0.86 F10 (0.50) F10

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-7700628-B2 Aromatic ether derivatives useful as thrombin inhibitors ELI LILLY AND COMPANY (US) 2010-04-20 US disclosed
EP-1817287-B1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS LILLY CO ELI (US) 2010-02-10 EP disclosed
US-20090227566-A1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS ELI LILLY AND COMPANY 2009-09-10 US disclosed
EP-1817287-A1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS Eli Lilly and Company (US) 2007-08-15 EP disclosed
WO-2006057845-A1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS ELI LILLY AND COMPANY (US) 2006-06-01 WO 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-20090227566-A1 AROMATIC ETHER DERIVATIVES USEFUL AS THROMBIN INHIBITORS TFPI, F2, F11 IRAK4 2856/4885F10 15/4885IRAK1 1124/4885

“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.