Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 19/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 18/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 18/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 18/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 18/20 | 0.53 |
| ▸ | HDAC5 | Q9UQL6 | 18/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 17/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 17/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 17/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 17/20 | 0.53 |
| ▸ | HDAC9 | Q9UKV0 | 17/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | BRD4 | O60885 | 1/20 | 0.44 |
| ▸ | NCOR1 | O75376 | 1/20 | 0.44 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.44 |
| ▸ | EGFR | P00533 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | NR0B1 | P51843 | 1/20 | 0.44 |
| ▸ | PLK1 | P53350 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL504491 | 1.00 | HDAC6 (0.53) | HDAC6HDAC4HDAC1HDAC11HDAC8 | |
| SCHEMBL7098726 | 0.86 | CYP1A2 (0.53) | HDAC6HDAC4HDAC1HDAC11HDAC8 | |
| SCHEMBL7261276 | 0.86 | CYP1A2 (0.53) | HDAC6HDAC4HDAC1HDAC11HDAC8 | |
| SCHEMBL7262289 | 0.86 | CYP1A2 (0.53) | HDAC6HDAC4HDAC1HDAC11HDAC8 | |
| SCHEMBL8919055 | 0.85 | HRH4 (0.40) | MAPT | |
| SCHEMBL8918750 | 0.83 | HRH4 (0.41) | MAPT | |
| SCHEMBL504172 | 0.83 | CYP1A2 (0.50) | HDAC6HDAC4HDAC1HDAC11HDAC8 | |
| SCHEMBL7900528 | 0.80 | HRH4 (0.54) | — | |
| SCHEMBL7898798 | 0.80 | HRH4 (0.54) | — | |
| SCHEMBL7902060 | 0.80 | HRH4 (0.54) | — |
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-20120029036-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING PYRIDYL CYANOGUANIDINE, PROCESS FOR PREPARING THE SAME AND USE THEREOF | TIANJIN MICHELE SCI-TECH DEVELOPMENT CO., LTD. (CN) | 2012-02-02 | — | — | US | disclosed |
| EP-2394649-A1 | PHARMACEUTICAL COMPOSITIONS CONTAINING PYRIDYL CYANOGUANIDINES, PREPARATION METHODS AND USES THEREOF | Tianjin Hemay Bio-Tech Co., Ltd. (CN) | 2011-12-14 | — | — | EP | 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-20120029036-A1 | PHARMACEUTICAL COMPOSITIONS COMPRISING PYRIDYL CYANOGUANIDINE, PROCESS FOR PREPARING THE SAME AND USE THEREOF | PLPBP, PYGL, QDPR | HDAC6 4113/4885HDAC4 4534/4885HDAC1 4336/4885 |
“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.