Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 7/20 | 0.51 |
| ▸ | HDAC8 | Q9BY41 | 7/20 | 0.51 |
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.51 |
| ▸ | PDE4B | Q07343 | 6/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.45 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL1544536 | 0.85 | HDAC1 (0.50) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL3912093 | 0.85 | HDAC1 (0.50) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL12522679 | 0.85 | HDAC1 (0.53) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL10029551 | 0.84 | HDAC1 (0.51) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL6386434 | 0.84 | HDAC1 (0.65) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL6438024 | 0.84 | HDAC1 (0.52) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL12377859 | 0.83 | HDAC1 (0.58) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL9900075 | 0.83 | ALDH1A1 (0.68) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL6437647 | 0.83 | HDAC1 (0.48) | HDAC1HDAC8HDAC6PDE4BALDH1A1 | |
| SCHEMBL21689281 | 0.82 | HDAC1 (0.68) | HDAC1HDAC8HDAC6PDE4BALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7998954-B2 | Pyrimidodiazepinone derivative | KYOWA HAKKO KIRIN CO., LTD. (JP) | 2011-08-16 | — | — | US | disclosed |
| US-20100190775-A1 | PYRIMIDODIAZEPINONE DERIVATIVE | KYOWA HAKKO KIRIN CO., LTD (JP) | 2010-07-29 | — | — | 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-20100190775-A1 | PYRIMIDODIAZEPINONE DERIVATIVE | KCNJ1, KCNJ11, ADRA1D | HDAC1 120/4885HDAC8 462/4885HDAC6 443/4885 |
“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.