Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | TET2 | Q6N021 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29039008 | 1.00 | ALDH1A1 (0.38) | ALDH1A1TSHRHTTMAPTTET2 | |
| SCHEMBL28648606 | 1.00 | ALDH1A1 (0.38) | ALDH1A1TSHRHTTMAPTTET2 | |
| SCHEMBL27776897 | 0.88 | ALDH1A1 (0.36) | ALDH1A1TSHRHTTMAPT | |
| SCHEMBL10773383 | 0.85 | ALDH1A1 (0.43) | ALDH1A1TSHRHTTMAPTTET2 | |
| SCHEMBL5998401 | 0.78 | MAPT (0.42) | ALDH1A1TSHRMAPT | |
| SCHEMBL5998393 | 0.78 | MAPT (0.42) | ALDH1A1TSHRMAPT | |
| Acetic Acid SCHEMBL8947198 | 0.77 | TET2 (0.43) | ALDH1A1TSHRHTTMAPTTET2 | |
| SCHEMBL5998397 | 0.77 | ALDH1A1 (0.35) | ALDH1A1TSHRHTT | |
| SCHEMBL30513348 | 0.76 | — | — | |
| SCHEMBL3256852 | 0.76 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114805068-B | Preparation method of chiral alpha-hydroxy-beta-keto ester compound | 南京工业大学 | 2023-07-21 | — | — | CN | disclosed |
| CN-113549062-B | Chiral quaternary ammonium salt phase transfer catalyst with high steric hindrance derived from cinchona alkaloid and synthesis method thereof | 南京工业大学 | 2022-08-09 | — | — | CN | disclosed |
| CN-114805068-A | Preparation method of chiral alpha-hydroxy-beta-keto ester compound | 南京工业大学 | 2022-07-29 | — | — | CN | disclosed |
| CN-113563187-A | Preparation method of chiral alpha-hydroxy-beta-keto ester compound | 南京工业大学 | 2021-10-29 | — | — | CN | disclosed |
| CN-113549062-A | Chiral quaternary ammonium salt phase transfer catalyst with high steric hindrance derived from cinchona alkaloid and synthesis method thereof | 南京工业大学 | 2021-10-26 | — | — | CN | disclosed |
| US-10053396-B2 | Process for the specific isotopic labeling of methyl groups of Val, Leu and Ile | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2018-08-21 | — | — | US | disclosed |
| US-20170275216-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2017-09-28 | — | — | US | disclosed |
| US-9708228-B2 | Process for the specific isotopic labeling of methyl groups of Val, Leu and Ile | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2017-07-18 | — | — | US | disclosed |
| US-9708228-B2 | Process for the specific isotopic labeling of methyl groups of Val, Leu and Ile | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2017-07-18 | — | — | US | disclosed |
| EP-2521704-B1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | COMMISSARIAT L ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2015-09-30 | — | — | EP | disclosed |
| WO-2014024151-A1 | LABELED CHIRAL ALPHA-HYDROXY KETOACID DERIVATIVES, A PROCESS FOR PREPARING SAID DERIVATIVES AND THEIR USE | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2014-02-13 | — | — | WO | disclosed |
| US-20130122598-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2013-05-16 | — | — | US | disclosed |
| US-20130122598-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2013-05-16 | — | — | US | disclosed |
| EP-2521704-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) | 2012-11-14 | — | — | EP | disclosed |
| EP-2521704-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) | 2012-11-14 | — | — | EP | disclosed |
| WO-2011083356-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2011-07-14 | — | — | WO | disclosed |
| WO-2011083356-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) | 2011-07-14 | — | — | WO | disclosed |
| EP-1818336-A1 | 2,2-bis-(4-hydroxyphenyl)-alkyl onium salt and a process for the preparation thereof | Council of Scientific and Industrial Research (IN) | 2007-08-15 | — | — | 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 (3 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-10053396-B2 | Process for the specific isotopic labeling of methyl groups of Val, Leu and Ile | BCAT1, BCAT2, ALAD | ALDH1A1 4057/4885TSHR 4559/4885HTT 3701/4885 |
| US-20130122598-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | BCAT1, BCAT2, SLC1A5 | ALDH1A1 4604/4885TSHR 4484/4885HTT 758/4885 |
| US-20170275216-A1 | PROCESS FOR THE SPECIFIC ISOTOPIC LABELING OF METHYL GROUPS OF VAL, LEU AND ILE | BCAT1, BCAT2, ALAD | ALDH1A1 4057/4885TSHR 4559/4885HTT 3701/4885 |
“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.