Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL7978424

CCOCCOCCOc1ccc2c(c1)CN[C@H](C(=O)N1CCC[C@H]1C#N)C2.O=C(O)C(F)(F)F

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 18/20 0.65
FAP Q12884 3/20 0.42
DPP8 Q6V1X1 3/20 0.41
PREP P48147 1/20 0.39
DPP9 Q86TI2 1/20 0.39

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
SCHEMBL7992099 0.94 DPP4 (0.73) DPP4FAP
SCHEMBL7992095 0.94 DPP4 (0.73) DPP4FAP
Trifluoroacetic Acid SCHEMBL7978160 0.92 DPP4 (0.69) DPP4FAPDPP8PREPDPP9
Trifluoroacetic Acid SCHEMBL7989205 0.86 DPP4 (0.88) DPP4FAPDPP8DPP9
SCHEMBL7992389 0.86 DPP4 (0.78) DPP4FAP
Trifluoroacetic Acid SCHEMBL7977945 0.85 DPP4 (0.66) DPP4DPP8PREP
SCHEMBL7977740 0.82 DPP4 (0.76) DPP4FAPDPP8
SCHEMBL7989090 0.82 DPP4 (0.76) DPP4PREP
SCHEMBL7989092 0.82 DPP4 (0.76) DPP4PREP
SCHEMBL7988645 0.82 DPP4 (0.70) DPP4FAP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6172081-B1 DIPEPTIDYL PEPTIDASE-IV INHIBITORS; NON-INSULIN DEPENDENT DIABETES NOVARTIS AG (CH) 2001-01-09 US disclosed