Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.55 |
| ▸ | ALOX15 | P16050 | 5/20 | 0.55 |
| ▸ | LMNA | P02545 | 4/20 | 0.55 |
| ▸ | HTT | P42858 | 2/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.55 |
| ▸ | MIF | P14174 | 1/20 | 0.55 |
| ▸ | TYR | P14679 | 1/20 | 0.55 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 4/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | ATP2A2 | P16615 | 1/20 | 0.48 |
| ▸ | ATP2A3 | Q93084 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.44 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL31146612 | 0.83 | ALDH1A1 (0.59) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL7199857 | 0.83 | ALDH1A1 (0.59) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL2919862 | 0.83 | ALDH1A1 (0.59) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL29836278 | 0.83 | ALDH1A1 (0.59) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL27622698 | 0.82 | ALOX15 (0.48) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL29603473 | 0.82 | TRPA1 (0.59) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL245857 | 0.82 | TRPA1 (0.59) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL5175624 | 0.82 | ALDH1A1 (0.57) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL3408135 | 0.81 | ALDH1A1 (0.70) | ALDH1A1ALOX15LMNAHTTCYP2C9 | |
| SCHEMBL29572639 | 0.81 | ALDH1A1 (0.70) | ALDH1A1ALOX15LMNAHTTCYP2C9 |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4463187-A | Process for the preparation of 3,5-dihydrocarbyl-4-hydroxybenzylmalonic acid esters | ETHYL CORPORATION (US) | 1984-07-31 | — | — | US | claimed |
| US-8673890-B2 | 2,3-dihydro-1H-isoindol-1-imine derivatives useful as thrombin PAR-1 receptor antagonist | JANSSEN PHARMACEUTICA NV (BE) | 2014-03-18 | — | — | US | disclosed |
| US-20110105490-A1 | 2,3-DIHYDRO-1H-ISOINDOL-1-IMINE DERIVATIVES USEFUL AS THROMBIN PAR-1 RECEPTOR ANTAGONIST | JANSSEN PHARMACEUTICA NV (BE) | 2011-05-05 | — | — | US | disclosed |
| EP-0163635-A4 | PROCESS FOR PREPARING SUBSTITUTED BENZYL MALONIC ACID ESTERS. | ETHYL CORP (US) | 1986-04-02 | — | — | EP | disclosed |
| EP-0163635-A1 | PROCESS FOR PREPARING SUBSTITUTED BENZYL MALONIC ACID ESTERS | ETHYL CORPORATION (US) | 1985-12-11 | — | — | EP | disclosed |
| WO-1985002182-A1 | PROCESS FOR PREPARING SUBSTITUTED BENZYL MALONIC ACID ESTERS | ETHYL CORPORATION (US) | 1985-05-23 | — | — | WO | disclosed |
| US-4463187-A | Process for the preparation of 3,5-dihydrocarbyl-4-hydroxybenzylmalonic acid esters | ETHYL CORPORATION (US) | 1984-07-31 | — | — | US | 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-20110105490-A1 | 2,3-DIHYDRO-1H-ISOINDOL-1-IMINE DERIVATIVES USEFUL AS THROMBIN PAR-1 RECEPTOR ANTAGONIST | F2R, F2RL1, F2RL3 | ALDH1A1 1921/4885ALOX15 847/4885LMNA 1425/4885 |
“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.