Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL21768145

NC/C(=C/F)COc1ccc(-c2ncccn2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.81

Full drug profile on Sugi Atlas →

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 18/20 0.81
AOC2 O75106 2/20 0.57
MAOA P21397 2/20 0.57
MAOB P27338 2/20 0.57
DAO P14920 1/20 0.57

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 SCHEMBL28901220 1.00 AOC3 (0.81) AOC3AOC2MAOAMAOBDAO
Trifluoroacetic Acid SCHEMBL21768062 1.00 AOC3 (0.81) AOC3AOC2MAOAMAOBDAO
SCHEMBL21780121 0.90 AOC3 (1.00) AOC3AOC2MAOAMAOBDAO
SCHEMBL21768149 0.90 AOC3 (1.00) AOC3AOC2MAOAMAOBDAO
SCHEMBL21780122 0.90 AOC3 (1.00) AOC3AOC2MAOAMAOBDAO
Hydrochloric Acid SCHEMBL23701778 0.89 AOC3 (0.97) AOC3AOC2MAOAMAOBDAO
Hydrochloric Acid SCHEMBL23701836 0.89 AOC3 (0.97) AOC3AOC2MAOAMAOBDAO
Trifluoroacetic Acid SCHEMBL30089444 0.79 MAPK14 (0.57) AOC3AOC2MAOAMAOBDAO
Trifluoroacetic Acid SCHEMBL21768130 0.79 MAPK14 (0.57) AOC3AOC2MAOAMAOBDAO
Trifluoroacetic Acid SCHEMBL30089391 0.79 MAPK14 (0.57) AOC3AOC2MAOAMAOBDAO

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
CN-110352188-B Fluoroallylamine derivatives and use thereof 四川科伦博泰生物医药股份有限公司 2022-11-29 CN disclosed
EP-3617186-A1 FLUOROALLYLAMINE DERIVATIVE AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2020-03-04 EP disclosed