Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3403495

C[C@@H]1CCCN1C(=O)CCC(N)C(=O)N1CCCC1C#N.O=C(O)C(F)(F)F

nearest known ligand 0.77

Full drug profile on Sugi Atlas →

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 19/20 0.77
DPP8 Q6V1X1 19/20 0.77
DPP7 Q9UHL4 6/20 0.67

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 SCHEMBL2400454 1.00 DPP4 (0.77) DPP4DPP8DPP7
SCHEMBL7995578 0.92 DPP4 (0.64) DPP4DPP8DPP7
Trifluoroacetic Acid SCHEMBL2398411 0.87 DPP4 (0.79) DPP4DPP8DPP7
Trifluoroacetic Acid SCHEMBL2403603 0.85 DPP4 (1.00) DPP4DPP8DPP7
Trifluoroacetic Acid SCHEMBL5531512 0.81 DPP4 (1.00) DPP4DPP8DPP7
Trifluoroacetic Acid SCHEMBL6824122 0.81 DPP4 (0.84) DPP4DPP8DPP7
Trifluoroacetic Acid SCHEMBL5649111 0.80 DPP4 (0.66) DPP4DPP8DPP7
Trifluoroacetic Acid SCHEMBL6824549 0.80 DPP7 (0.83) DPP4DPP8DPP7
SCHEMBL3406474 0.79 DPP4 (0.76) DPP4DPP8DPP7
SCHEMBL2398412 0.79 DPP4 (0.76) DPP4DPP8DPP7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2252582-A2 PYRROLIDINE DERIVATIVES National Health Research Institutes (TW) 2010-11-24 EP disclosed
WO-2009111239-A2 PYRROLIDINE DERIVATIVES NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2009-09-11 WO disclosed