Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ELANE | P08246 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 5/20 | 0.45 |
| ▸ | CES1 | P23141 | 5/20 | 0.45 |
| ▸ | TSHR | P16473 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | AKT1 | P31749 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL9848557 | 1.00 | ELANE (0.46) | ELANECES2CES1TSHRALDH1A1 | |
| SCHEMBL29180078 | 1.00 | ELANE (0.46) | ELANECES2CES1TSHRALDH1A1 | |
| SCHEMBL6936445 | 0.86 | ELANE (0.44) | ELANECES2CES1TSHRALDH1A1 | |
| SCHEMBL7132464 | 0.85 | TSHR (0.45) | CES2CES1TSHRALDH1A1CYP3A4 | |
| SCHEMBL11421432 | 0.84 | ELANE (0.43) | ELANECES2CES1TSHRALDH1A1 | |
| SCHEMBL11421430 | 0.84 | ELANE (0.43) | ELANECES2CES1TSHRALDH1A1 | |
| SCHEMBL29006131 | 0.83 | TSHR (0.54) | CES2CES1TSHRALDH1A1F2 | |
| SCHEMBL10006253 | 0.82 | AKR1C3 (0.50) | ELANETSHRALDH1A1LMNATDP1 | |
| SCHEMBL21086761 | 0.82 | ELANE (0.42) | ELANECES2CES1TSHRALDH1A1 | |
| SCHEMBL4982106 | 0.82 | AKR1C3 (0.50) | ELANETSHRALDH1A1LMNATDP1 |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114436831-A | Synthesis method of chiral 1-phenylpropyl acetate compound | 中国科学院大连化学物理研究所 | 2022-05-06 | — | — | CN | claimed |
| CN-114436831-A | Synthesis method of chiral 1-phenylpropyl acetate compound | 中国科学院大连化学物理研究所 | 2022-05-06 | — | — | CN | disclosed |
| CN-114436831-A | Synthesis method of chiral 1-phenylpropyl acetate compound | 中国科学院大连化学物理研究所 | 2022-05-06 | — | — | CN | disclosed |
| EP-3184504-B1 | METHODS OF PREPARING ALPHA,BETA-UNSATURATED OR ALPHA-HALO KETONES AND ALDEHYDES | INT FLAVORS & FRAGRANCES INC (US) | 2018-05-02 | — | — | EP | disclosed |
| US-9796653-B2 | Methods of preparing α,β-unsaturated or α-halo ketones and aldehydes | INTERNATIONAL FLAVORS & FRAGRANCES INC. (US) | 2017-10-24 | — | — | US | disclosed |
| EP-3184504-A1 | METHODS OF PREPARING ALPHA,BETA-UNSATURATED OR ALPHA-HALO KETONES AND ALDEHYDES | International Flavors & Fragrances Inc. (US) | 2017-06-28 | — | — | EP | disclosed |
| US-20170174607-A1 | METHODS OF PREPARING a,ß-UNSATURATED OR a-HALO KETONES AND ALDEHYDES | INT FLAVORS & FRAGRANCES INC (US) | 2017-06-22 | — | — | US | disclosed |
| EP-0428343-A1 | A process for producing an alpha,beta-unsaturated carbonyl compound | NIPPON ZEON CO., LTD. (JP) | 1991-05-22 | — | — | 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.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20170174607-A1 | METHODS OF PREPARING a,ß-UNSATURATED OR a-HALO KETONES AND ALDEHYDES | DBH, DOHH, DHCR7 | ELANE 2147/4885CES2 425/4885CES1 303/4885 |
“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.