Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL8902193

CCc1nccn1-c1cc(C(=O)O)ccc1NC(C)=O.O=C(O)C(F)(F)F

nearest known ligand 0.39

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.39
HPGD P15428 4/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NEU3 Q9UQ49 1/20 0.37
F2 P00734 1/20 0.36
F10 P00742 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
KDM4E B2RXH2 3/20 0.35
GAA P10253 3/20 0.35
MAPT P10636 3/20 0.35
THRB P10828 2/20 0.35
HTT P42858 1/20 0.35
GFER P55789 1/20 0.35
PLEC Q15149 1/20 0.35
ALPG P10696 2/20 0.35

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
SCHEMBL8900520 0.94 ALDH1A1 (0.43) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
Trifluoroacetic Acid SCHEMBL8901557 0.86 NEU3 (0.42) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL8902205 0.85 ALPG (0.35) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
Trifluoroacetic Acid SCHEMBL8900639 0.79 MAPT (0.38) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL8900474 0.79 NEU3 (0.47) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
Trifluoroacetic Acid SCHEMBL8901207 0.71 ALDH1A1 (0.40) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL8902702 0.71 ALDH1A1 (0.42) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
SCHEMBL8901564 0.71 ALDH1A1 (0.34) ALDH1A1HPGDKMT2AF2F10
SCHEMBL8901433 0.70 ALDH1A1 (0.44) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A
Trifluoroacetic Acid SCHEMBL8894608 0.70 ADORA3 (0.40) ALDH1A1HPGDSMN1; SMN2MEN1KMT2A

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-1997033872-A1 ANTI-VIRAL 4-ACYLAMINO-3-[IMIDAZOL-I-YL]-BENZOIC ACID DERIVATIVES BIOTA SCIENTIFIC MANAGEMENT PTY. LTD. (AU) 1997-09-18 WO disclosed