Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL4735033

CC(C)(C)Cn1cnc(C(=O)O)c1.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PLA2G4A P47712 1/20 0.36
▸ KDM4E B2RXH2 1/20 0.35
▸ CNR2 P34972 1/20 0.34
▸ KDM4A O75164 1/20 0.33
▸ KDM5A P29375 1/20 0.33
▸ KDM4C Q9H3R0 1/20 0.33
▸ KDM5B Q9UGL1 1/20 0.33
▸ MLYCD O95822 1/20 0.33
▸ AR P10275 1/20 0.32
▸ HRH4 Q9H3N8 3/20 0.32
▸ HRH3 Q9Y5N1 2/20 0.32
▸ SMYD3 Q9H7B4 1/20 0.32
▸ ASPH Q12797 1/20 0.30
▸ TLR7 Q9NYK1 1/20 0.30

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
SCHEMBL4738757 0.92 PLA2G4A (0.40) PLA2G4AKDM4ECNR2KDM4AKDM5A
Trifluoroacetic Acid SCHEMBL4737904 0.77 KDM4C (0.50) KDM4AKDM5AKDM4CKDM5B
SCHEMBL4733881 0.74 GABRG2 (0.35) SMYD3
SCHEMBL151394 0.73 SMYD3 (0.50) PLA2G4AKDM4EKDM5AKDM5BSMYD3
SCHEMBL3690823 0.73 PLA2G4A (0.39) PLA2G4AKDM4EKDM4AKDM5AKDM4C
SCHEMBL30323016 0.73 PLA2G4A (0.36) PLA2G4AKDM4ECNR2KDM5AKDM4C
SCHEMBL3689829 0.71 PLA2G4A (0.40) PLA2G4AKDM4EKDM5AKDM4CKDM5B
SCHEMBL710279 0.70 KDM5A (0.54) PLA2G4AKDM4EKDM5AKDM4CKDM5B
SCHEMBL4590582 0.70 PLA2G4A (0.42) PLA2G4AKDM4EKDM4AKDM5AKDM4C
SCHEMBL4901656 0.70 PLA2G4A (0.39) PLA2G4AKDM4EKDM5AKDM4CKDM5B

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
WO-2008073461-A2 ION CHANNEL MODULATORS WYETH (US) 2008-06-19 — — WO disclosed
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