Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4716561

NCCC1CCN(c2ccncc2)CC1.O=C(O)C(F)(F)F

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 5/20 0.55
DPP8 Q6V1X1 5/20 0.55
DPP7 Q9UHL4 4/20 0.55
DPP9 Q86TI2 4/20 0.55
ITGB3 P05106 8/20 0.45
ITGA2B P08514 8/20 0.45
SLC2A1 P11166 3/20 0.45
LSS P48449 1/20 0.42
CYP2D6 P10635 2/20 0.41
KCNH2 Q12809 1/20 0.41
CHRM2 P08172 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP3A4 P08684 1/20 0.40
TSHR P16473 1/20 0.40
HIF1A Q16665 1/20 0.40

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 SCHEMBL6066623 0.91 DPP4 (0.53) DPP4DPP8DPP7DPP9ITGB3
Trifluoroacetic Acid SCHEMBL6066398 0.91 DPP4 (0.53) DPP4DPP8DPP7DPP9ITGB3
Trifluoroacetic Acid SCHEMBL1456260 0.91 DPP4 (0.53) DPP4DPP8DPP7DPP9ITGB3
SCHEMBL785766 0.87 CHKA (0.50) DPP4DPP8DPP7DPP9ITGB3
Hydrochloric Acid SCHEMBL2338735 0.86 CHKA (0.48) DPP4DPP8DPP7DPP9ITGB3
Trifluoroacetic Acid SCHEMBL1025272 0.85 ITGB3 (0.59) DPP4DPP8DPP7DPP9ITGB3
Trifluoroacetic Acid SCHEMBL1456945 0.83 DPP4 (0.59) DPP4DPP8DPP7DPP9ITGB3
Trifluoroacetic Acid SCHEMBL1648792 0.81 ITGB3 (0.56) DPP4DPP8DPP7DPP9ITGB3
Trifluoroacetic Acid SCHEMBL8120233 0.80 DPP4 (0.45) DPP4DPP8DPP7DPP9ITGB3
Trifluoroacetic Acid SCHEMBL8126751 0.79 ADRB2 (0.48) DPP4DPP8DPP7DPP9ITGB3

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-1877401-A2 NOVEL COMPOUNDS USEFUL FOR BRADYKININ B1 RECEPTOR ANTAGONISM Elan Pharmaceuticals Inc. (US) 2008-01-16 EP disclosed
US-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism ELAN PHARMACEUTICALS, INC. 2007-02-08 US disclosed
WO-2006113140-A2 NOVEL COMPOUNDS USEFUL FOR BRADYKININ B1 RECEPTOR ANTAGONISM ELAN PHARMACEUTICALS, INC. (US) 2006-10-26 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-20070032475-A1 Novel compounds useful for bradykinin B1 receptor antagonism BDKRB1, BDKRB2, NPBWR1 DPP4 2122/4885DPP8 1836/4885DPP7 1856/4885

“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.