Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL3877608

CC#CCn1c(=O)n(CC(=O)O)c2nc(Cl)nc(N3CCNCC3)c21.O=C(O)C(F)(F)F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DPP4 P27487 16/20 0.41
P2RX3 P56373 3/20 0.37
FAP Q12884 5/20 0.34
DPP9 Q86TI2 1/20 0.34
HRH4 Q9H3N8 1/20 0.33

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
SCHEMBL13866884 0.94 DPP4 (0.45) DPP4P2RX3FAPDPP9
Trifluoroacetic Acid SCHEMBL3875365 0.93 DPP4 (0.40) DPP4P2RX3FAPDPP9HRH4
Trifluoroacetic Acid SCHEMBL3874704 0.91 DPP4 (0.39) DPP4P2RX3FAPDPP9HRH4
Trifluoroacetic Acid SCHEMBL3875820 0.91 DPP4 (0.43) DPP4P2RX3FAPDPP9HRH4
Trifluoroacetic Acid SCHEMBL3883168 0.90 DPP4 (0.41) DPP4P2RX3FAPDPP9
Trifluoroacetic Acid SCHEMBL3879690 0.90 DPP4 (0.52) DPP4FAPDPP9
Trifluoroacetic Acid SCHEMBL3877229 0.89 DPP4 (0.40) DPP4P2RX3FAPDPP9
Trifluoroacetic Acid SCHEMBL3879206 0.88 DPP4 (0.41) DPP4P2RX3FAPDPP9
Trifluoroacetic Acid SCHEMBL3885741 0.88 DPP4 (0.53) DPP4P2RX3FAPDPP9
SCHEMBL3877614 0.87 DPP4 (0.40) DPP4P2RX3FAPDPP9

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
US-7524847-B2 Fused 1,3-dihydro-imidazole ring compounds EISAI R&D MANAGEMENT CO., LTD. (JP) 2009-04-28 US disclosed
EP-1568699-A1 1,3-DIHYDROIMIDAZOLE FUSED-RING COMPOUND Eisai Co., Ltd. (JP) 2005-08-31 EP disclosed