Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 9/20 | 0.66 |
| ▸ | TAF1 | P21675 | 3/20 | 0.66 |
| ▸ | PLK1 | P53350 | 14/20 | 0.62 |
| ▸ | ALK | Q9UM73 | 3/20 | 0.53 |
| ▸ | BRDT | Q58F21 | 5/20 | 0.52 |
| ▸ | PLK3 | Q9H4B4 | 6/20 | 0.51 |
| ▸ | PLK2 | Q9NYY3 | 4/20 | 0.51 |
| ▸ | DAPK3 | O43293 | 2/20 | 0.51 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.51 |
| ▸ | CHEK2 | O96017 | 2/20 | 0.51 |
| ▸ | EGFR | P00533 | 2/20 | 0.51 |
| ▸ | FES | P07332 | 2/20 | 0.51 |
| ▸ | PHKG2 | P15735 | 2/20 | 0.51 |
| ▸ | CSNK1D | P48730 | 2/20 | 0.51 |
| ▸ | CLK2 | P49760 | 2/20 | 0.51 |
| ▸ | NEK2 | P51955 | 2/20 | 0.51 |
| ▸ | PTK2 | Q05397 | 2/20 | 0.51 |
| ▸ | CAMK2B | Q13554 | 2/20 | 0.51 |
| ▸ | CAMK2G | Q13555 | 2/20 | 0.51 |
| ▸ | CAMK2D | Q13557 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL4080359 | 0.92 | BRD4 (0.77) | BRD4TAF1PLK1ALKBRDT | |
| SCHEMBL4075904 | 0.92 | BRD4 (0.55) | BRD4TAF1PLK1ALKBRDT | |
| SCHEMBL4078301 | 0.89 | PLK1 (0.67) | BRD4TAF1PLK1ALKBRDT | |
| SCHEMBL3667459 | 0.89 | PLK1 (0.55) | BRD4TAF1PLK1ALKBRDT | |
| SCHEMBL1560017 | 0.84 | PLK1 (0.85) | BRD4TAF1PLK1ALKBRDT | |
| SCHEMBL4081000 | 0.84 | BRD4 (0.65) | BRD4TAF1PLK1ALKBRDT | |
| SCHEMBL4079129 | 0.84 | PLK1 (0.57) | BRD4TAF1PLK1BRDTPLK3 | |
| SCHEMBL3672321 | 0.83 | PLK1 (0.58) | BRD4TAF1PLK1ALKBRDT | |
| SCHEMBL4079275 | 0.82 | BRD4 (0.54) | BRD4TAF1PLK1BRDTPLK3 | |
| SCHEMBL4085018 | 0.82 | PLK1 (0.55) | BRD4TAF1PLK1BRDTPLK3 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7517873-B2 | Substituted pyrimidodiazepines | HOFFMAN-LA ROCHE INC. (US) | 2009-04-14 | — | — | US | disclosed |
| US-7517873-B2 | Substituted pyrimidodiazepines | HOFFMAN-LA ROCHE INC. (US) | 2009-04-14 | — | — | US | disclosed |
| US-7517873-B2 | Substituted pyrimidodiazepines | HOFFMAN-LA ROCHE INC. (US) | 2009-04-14 | — | — | US | disclosed |
| US-20080234255-A1 | SUBSTITUTED PYRIMIDODIAZEPINES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-09-25 | — | — | US | disclosed |
| US-20080234255-A1 | SUBSTITUTED PYRIMIDODIAZEPINES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-09-25 | — | — | US | disclosed |
| US-20080234255-A1 | SUBSTITUTED PYRIMIDODIAZEPINES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2008-09-25 | — | — | 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-20080234255-A1 | SUBSTITUTED PYRIMIDODIAZEPINES | PLK1, CCNI, CDK1 | BRD4 123/4885TAF1 3573/4885PLK1 1/4885 |
“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.