Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 5/20 | 0.38 |
| ▸ | CA5A | P35218 | 2/20 | 0.38 |
| ▸ | LIG1 | P18858 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 3/20 | 0.38 |
| ▸ | CA1 | P00915 | 3/20 | 0.38 |
| ▸ | CA9 | Q16790 | 3/20 | 0.38 |
| ▸ | RHOA | P61586 | 1/20 | 0.38 |
| ▸ | MMP1 | P03956 | 1/20 | 0.38 |
| ▸ | MMP2 | P08253 | 1/20 | 0.38 |
| ▸ | MMP9 | P14780 | 1/20 | 0.38 |
| ▸ | MMP12 | P39900 | 1/20 | 0.38 |
| ▸ | GPR52 | Q9Y2T5 | 1/20 | 0.37 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28030373 | 0.88 | CYP3A4 (0.56) | CYP3A4NPSR1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL6404376 | 0.88 | CYP3A4 (0.42) | CYP3A4NPSR1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL7113446 | 0.84 | CYP3A4 (0.49) | CYP3A4NPSR1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL31290664 | 0.82 | CYP3A4 (0.50) | CYP3A4NPSR1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL878244 | 0.81 | CYP3A4 (0.49) | CYP3A4NPSR1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL8973261 | 0.81 | ALDH1A1 (0.58) | CYP3A4NPSR1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL11128484 | 0.79 | CYP3A4 (0.47) | CYP3A4NPSR1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL6032361 | 0.78 | L3MBTL1 (0.47) | CYP3A4NPSR1SMN1; SMN2TSHRKDM4E | |
| SCHEMBL28521498 | 0.78 | TDP1 (0.54) | CYP3A4NPSR1PKMSMN1; SMN2ALDH1A1 | |
| SCHEMBL852520 | 0.78 | PKM (0.53) | PKMSMN1; SMN2ALDH1A1TSHRHSD17B10 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2099776-B1 | CHELATING AGENT | UNIV MUENCHEN TECH (DE) | 2015-10-07 | — | — | EP | disclosed |
| US-20100081799-A1 | Chelating Agent | TECHNISCHE UNIVERSITAT MUNCHEN (DE) | 2010-04-01 | — | — | US | disclosed |
| EP-2099776-A1 | CHELATING AGENT | Technische Universität München (DE) | 2009-09-16 | — | — | EP | disclosed |
| WO-2008068516-A1 | CHELATING AGENT | Technische Universität München (DE) | 2008-06-12 | — | — | 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 (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-20100081799-A1 | Chelating Agent | HRH3, C3AR1, H1-3 | CYP3A4 2762/4885NPSR1 1170/4885PKM 3850/4885 |
“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.