Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | KDM5A | P29375 | 2/20 | 0.32 |
| ▸ | KDM3A | Q9Y4C1 | 2/20 | 0.32 |
| ▸ | JMJD1C | Q15652 | 1/20 | 0.32 |
| ▸ | KDM6B | O15054 | 1/20 | 0.32 |
| ▸ | TET3 | O43151 | 1/20 | 0.32 |
| ▸ | KDM4A | O75164 | 1/20 | 0.32 |
| ▸ | BBOX1 | O75936 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | KDM5C | P41229 | 1/20 | 0.32 |
| ▸ | ASPH | Q12797 | 1/20 | 0.32 |
| ▸ | KDM4D | Q6B0I6 | 1/20 | 0.32 |
| ▸ | TET2 | Q6N021 | 1/20 | 0.32 |
| ▸ | ALKBH5 | Q6P6C2 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL12452885 | 0.89 | ALDH1A1 (0.38) | ALDH1A1HDAC1HDAC8HDAC6PTPN1 | |
| Valine SCHEMBL313633 | 0.86 | SLC7A5 (0.35) | ALDH1A1PTPN1 | |
| SCHEMBL12453022 | 0.86 | HDAC1 (0.49) | ALDH1A1HDAC1HDAC8HDAC6PTPN1 | |
| SCHEMBL10025450 | 0.75 | ALDH1A1 (0.36) | ALDH1A1HDAC1HDAC8HDAC6PTPN1 | |
| SCHEMBL12522843 | 0.74 | ALDH1A1 (0.45) | ALDH1A1HDAC1HDAC8HDAC6PTPN1 | |
| SCHEMBL12299161 | 0.74 | ALDH1A1 (0.38) | ALDH1A1HDAC1HDAC8HDAC6PTPN1 | |
| SCHEMBL29907677 | 0.72 | KDM4E (0.40) | ALDH1A1KDM4EKDM5AKDM3AKDM6B | |
| SCHEMBL30114679 | 0.72 | GLRA3 (0.46) | ALDH1A1HDAC1HDAC8HDAC6PDE4B | |
| SCHEMBL12452968 | 0.72 | HDAC1 (0.40) | ALDH1A1HDAC1HDAC8HDAC6PTPN1 | |
| SCHEMBL12571362 | 0.71 | ALDH1A1 (0.45) | ALDH1A1HDAC1HDAC8HDAC6PTPN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-8729060-B2 | Macrocyclic polyoxazole compounds and use thereof | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2014-05-20 | — | — | US | disclosed |
| US-20110230531-A1 | THERAPEUTIC COMPOUNDS | NIH - DEITR | 2011-09-22 | — | — | US | disclosed |
| EP-2183256-A1 | THERAPEUTIC COMPOUNDS | Rutgers, The State University of New Jersey (US) | 2010-05-12 | — | — | EP | disclosed |
| WO-2009018549-A1 | THERAPEUTIC COMPOUNDS | RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) | 2009-02-05 | — | — | 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-20110230531-A1 | THERAPEUTIC COMPOUNDS | MCL1, MKI67, NCL | ALDH1A1 499/4885HDAC1 114/4885HDAC8 769/4885 |
“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.