Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAP1LC3B | Q9GZQ8 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HTR2C | P28335 | 6/20 | 0.36 |
| ▸ | HTR2B | P41595 | 6/20 | 0.36 |
| ▸ | ACHE | P22303 | 2/20 | 0.35 |
| ▸ | HTR2A | P28223 | 4/20 | 0.35 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21662339 | 0.81 | CFTR (0.40) | BRD4KDM1AALDH1A1MAP1LC3BMAPK1 | |
| SCHEMBL21662341 | 0.76 | TNKS2 (0.36) | BRD4KDM1AALDH1A1MAP1LC3BHTR2C | |
| SCHEMBL19781085 | 0.69 | MAP1LC3B (0.44) | BRD4KDM1AALDH1A1MAP1LC3BCYP3A4 | |
| SCHEMBL19934179 | 0.65 | ALDH1A1 (0.45) | BRD4KDM1AALDH1A1MAP1LC3BCYP3A4 | |
| SCHEMBL12876076 | 0.65 | KDM1A (0.61) | BRD4KDM1AALDH1A1MAP1LC3BCYP3A4 | |
| SCHEMBL31172423 | 0.65 | KDM1A (0.61) | BRD4KDM1AALDH1A1MAP1LC3BCYP3A4 | |
| SCHEMBL6062661 | 0.65 | ACHE (0.47) | SMN1; SMN2HTR2CHTR2BACHEHTR2A | |
| SCHEMBL21197721 | 0.64 | MAPK1 (0.41) | BRD4KDM1AALDH1A1MAP1LC3BCYP3A4 | |
| SCHEMBL6062663 | 0.64 | HTR2A (0.35) | ALDH1A1HTR2CHTR2BACHEHTR2A | |
| SCHEMBL23956031 | 0.63 | MAP1LC3B (0.32) | BRD4ALDH1A1MAP1LC3BCYP3A4CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3601257-B1 | AROMATIC COMPOUNDS | MERCK PATENT GMBH (DE) | 2021-10-27 | — | — | EP | disclosed |
| US-20200039903-A1 | AROMATIC COMPOUNDS | MERCK PATENT GMBH (DE) | 2020-02-06 | — | — | 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-20200039903-A1 | AROMATIC COMPOUNDS | PAH, ALG3, DDC | BRD4 337/4885KDM1A 2124/4885ALDH1A1 666/4885 |
“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.