Trifluoroacetic Acid

Trifluoroacetic Acid

SCHEMBL21768076

NCC(=CF)COc1ccc(C(=O)N2CCc3cc(C(F)(F)F)ccc3C2)cc1.O=C(O)C(F)(F)F

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AOC3 Q16853 15/20 0.51
AOC2 O75106 2/20 0.47
MAOB P27338 2/20 0.45
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
MAOA P21397 2/20 0.42

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
SCHEMBL21780087 0.96 AOC3 (0.52) AOC3AOC2MAOBCA1CA2
Trifluoroacetic Acid SCHEMBL30089516 0.88 AOC3 (0.52) AOC3AOC2MAOBCA1CA2
Trifluoroacetic Acid SCHEMBL21768084 0.88 AOC3 (0.52) AOC3AOC2MAOBCA1CA2
Trifluoroacetic Acid SCHEMBL21768080 0.88 AOC3 (0.52) AOC3AOC2MAOBCA1CA2
Trifluoroacetic Acid SCHEMBL21768159 0.88 AOC3 (0.52) AOC3AOC2MAOBCA1CA2
SCHEMBL21780142 0.82 AOC2 (0.56) AOC3AOC2MAOBCA1CA2
SCHEMBL21780132 0.82 AOC2 (0.56) AOC3AOC2MAOBCA1CA2
Trifluoroacetic Acid SCHEMBL21768119 0.82 AOC2 (0.48) AOC3AOC2MAOBMAOA
SCHEMBL21780085 0.82 CA1 (0.40) AOC3MAOBCA1CA2CA7
Trifluoroacetic Acid SCHEMBL30089479 0.78 HPGD (0.45) AOC3CA1CA2CA7CA9

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 3 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
US-20200087248-A1 Fluoroallylamine Derivative And Use Thereof SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2020-03-19 US disclosed
EP-3617186-A1 FLUOROALLYLAMINE DERIVATIVE AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2020-03-04 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200087248-A1 Fluoroallylamine Derivative And Use Thereof VAPB, VAPA, SLC28A1 AOC3 6/4885AOC2 16/4885MAOB 60/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.