Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 6/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 1/20 | 0.37 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.37 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.37 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.37 |
| ▸ | PDE11A | Q9HCR9 | 1/20 | 0.37 |
| ▸ | PIK3CD | O00329 | 8/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.36 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL95758 | 0.89 | PIK3CA (0.46) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A | |
| SCHEMBL97744 | 0.88 | PIK3CA (0.45) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A | |
| SCHEMBL97915 | 0.87 | ALDH1A1 (0.46) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A | |
| SCHEMBL98503 | 0.87 | PIK3CA (0.44) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A | |
| SCHEMBL98098 | 0.87 | PIK3CA (0.49) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A | |
| SCHEMBL98394 | 0.87 | ALDH1A1 (0.45) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A | |
| SCHEMBL99312 | 0.86 | PIK3CA (0.43) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A | |
| SCHEMBL97922 | 0.86 | PIK3CA (0.43) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A | |
| SCHEMBL100480 | 0.85 | ALDH1A1 (0.47) | PIK3CAHDAC1ALDH1A1NPSR1LMNA | |
| SCHEMBL99246 | 0.85 | PIK3CA (0.43) | PIK3CAHDAC1ALDH1A1NPSR1PDE4A |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120088765-A1 | PURINE DERIVATIVE AND ANTITUMOR AGENT USING SAME | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 2012-04-12 | — | — | 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-20120088765-A1 | PURINE DERIVATIVE AND ANTITUMOR AGENT USING SAME | PNP, TYMP, DPYD | PIK3CA 1539/4885HDAC1 3179/4885ALDH1A1 336/4885 |
“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.