Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 10/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | NCF1 | P14598 | 2/20 | 0.34 |
| ▸ | ADRB2 | P07550 | 3/20 | 0.34 |
| ▸ | ADRB1 | P08588 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL7922755 | 0.74 | HTT (0.35) | ALDH1A1KDM4EGAAMAPK1HTT | |
| SCHEMBL1013751 | 0.74 | GABRA1 (0.34) | — | |
| SCHEMBL9324541 | 0.74 | KDM4E (0.50) | ALDH1A1KDM4EHTTTDP1MEN1 | |
| Hydrochloric Acid SCHEMBL512162 | 0.73 | GABRA1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL9398193 | 0.72 | GABRA1 (0.35) | ALDH1A1KDM4EMAPK1NCF1ADRB2 | |
| Hydrochloric Acid SCHEMBL7785893 | 0.71 | KMT2A (0.48) | ALDH1A1MAPK1HTTTDP1MEN1 | |
| SCHEMBL25267340 | 0.70 | GABRA1 (0.31) | — | |
| Water SCHEMBL11423879 | 0.70 | KMT2A (0.48) | ALDH1A1MAPK1HTTTDP1MEN1 | |
| Hydrochloric Acid SCHEMBL1858922 | 0.70 | GABRA1 (0.31) | — | |
| Hydrochloric Acid SCHEMBL11607442 | 0.69 | GABRA1 (0.30) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6225260-B1 | USE OF SUCH COMPOUNDS AS PESTICIDES, HERBICIDES, FUNGICIDES, AND PLANT GROWTH REGULATING AGENTS. | LONZA INC. | 2001-05-01 | — | — | US | claimed |
| US-10793586-B2 | Quaternary ammonium etidronates | INNOVATIVE WATER CARE, LLC (US) | 2020-10-06 | — | — | US | disclosed |
| EP-3691450-A1 | QUATERNARY AMMONIUM ETIDRONATES | Innovative Water Care, LLC (US) | 2020-08-12 | — | — | EP | disclosed |
| US-20190106445-A1 | QUATERNARY AMMONIUM ETIDRONATES | THE BANK OF NEW YORK MELLON TRUST COMPANY, N.A., AS NOTES COLLATERAL AGENT | 2019-04-11 | — | — | US | disclosed |
| WO-2019071070-A1 | QUATERNARY AMMONIUM ETIDRONATES | ARCH CHEMICALS, INC. (US) | 2019-04-11 | — | — | WO | 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 (2 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-10793586-B2 | Quaternary ammonium etidronates | POLR1C, QARS1, ATP6V1E1 | ALDH1A1 2381/4885KDM4E 440/4885GAA 167/4885 |
| US-20190106445-A1 | QUATERNARY AMMONIUM ETIDRONATES | POLR1C, QARS1, ATP6V1E1 | ALDH1A1 2381/4885KDM4E 440/4885GAA 167/4885 |
“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.