Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8516655

CCN(CC)C(=O)Cn1cc(-c2nc3cc(Cl)c(Cl)cc3n(C(C)CN)c2=O)c2ccccc21.O=C(O)C(F)(F)F

nearest known ligand 0.36

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4D Q08499 1/20 0.36
PTGDR2 Q9Y5Y4 2/20 0.36
KMT2A Q03164 4/20 0.36
MEN1 O00255 3/20 0.36
USP2 O75604 1/20 0.36
LMNA P02545 2/20 0.36
ALDH1A1 P00352 2/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
IDE P14735 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
Trifluoroacetic Acid SCHEMBL8368691 0.91 TP53 (0.39) TP53PDE4BPDE4DPTGDR2KMT2A
Trifluoroacetic Acid SCHEMBL8365308 0.87 CFTR (0.40) TP53PDE4BPDE4DPTGDR2KMT2A
Trifluoroacetic Acid SCHEMBL8516078 0.85 USP2 (0.39) TP53PDE4BPDE4DPTGDR2KMT2A
Trifluoroacetic Acid SCHEMBL8367895 0.84 PTGDR2 (0.36) TP53PDE4BPDE4DPTGDR2KMT2A
Trifluoroacetic Acid SCHEMBL8516666 0.84 USP2 (0.38) TP53PDE4BPDE4DPTGDR2KMT2A
Trifluoroacetic Acid SCHEMBL8516685 0.83 MEN1 (0.40) TP53PDE4BPDE4DPTGDR2KMT2A
Trifluoroacetic Acid SCHEMBL8516518 0.83 USP2 (0.37) TP53PDE4BPDE4DPTGDR2KMT2A
Trifluoroacetic Acid SCHEMBL8367899 0.83 LMNA (0.44) PDE4BPDE4DKMT2AMEN1USP2
SCHEMBL8516657 0.82 PDE4B (0.32) PDE4BPDE4DPOLB
Trifluoroacetic Acid SCHEMBL8516758 0.81 PTGDR2 (0.39) TP53PDE4BPDE4DPTGDR2KMT2A

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
WO-1999046260-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 1999-09-16 WO claimed
WO-1999046260-A1 NEW COMPOUNDS ASTRAZENECA AB (SE) 1999-09-16 WO disclosed