Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 3/20 | 0.58 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.58 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.52 |
| ▸ | PRKACA | P17612 | 2/20 | 0.51 |
| ▸ | GSK3A | P49840 | 2/20 | 0.51 |
| ▸ | GSK3B | P49841 | 2/20 | 0.51 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.51 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.51 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.51 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.51 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.51 |
| ▸ | AURKA | O14965 | 1/20 | 0.51 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.51 |
| ▸ | GRK5 | P34947 | 1/20 | 0.51 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.51 |
| ▸ | CDK8 | P49336 | 1/20 | 0.51 |
| ▸ | PRKX | P51817 | 1/20 | 0.51 |
| ▸ | PRKCQ | Q04759 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL5046005 | 0.84 | HDAC3 (0.59) | HDAC3HDAC4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL5046007 | 0.84 | HDAC3 (0.59) | HDAC3HDAC4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL6030810 | 0.84 | HDAC3 (0.76) | HDAC3HDAC4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL6030805 | 0.84 | HDAC3 (0.76) | HDAC3HDAC4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL4461433 | 0.81 | ROCK1 (0.55) | HDAC3HDAC4HDAC1HDAC6PRKACA | |
| SCHEMBL5049377 | 0.79 | PRKACA (0.53) | HDAC3HDAC4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL6030791 | 0.78 | HDAC3 (0.57) | HDAC3HDAC4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL6030794 | 0.78 | HDAC3 (0.57) | HDAC3HDAC4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL4664658 | 0.78 | HDAC3 (0.57) | HDAC3HDAC4HDAC1HDAC6ALDH1A1 | |
| SCHEMBL6227427 | 0.77 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1POLBF7F2 |
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-7396944-B2 | Thiophene derivatives, their manufacture and use as pharmaceutical agents | HOFFMANN-LA ROCHE INC. (US) | 2008-07-08 | — | — | US | disclosed |
| US-20070232602-A1 | Thiophene Derivatives, Their Manufacture and Use as Pharmaceutical Agents | HOFFMAN-LA ROCHE INC. | 2007-10-04 | — | — | 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-20070232602-A1 | Thiophene Derivatives, Their Manufacture and Use as Pharmaceutical Agents | TPMT, ABCB1, CYP3A5 | HDAC3 3854/4885HDAC4 4101/4885HDAC1 2685/4885 |
“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.