Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 5/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 2/20 | 0.41 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.40 |
| ▸ | RAB9A | P51151 | 4/20 | 0.40 |
| ▸ | TP53 | P04637 | 3/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.40 |
| ▸ | RELA | Q04206 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL21662359 | 0.88 | HSD11B1 (0.46) | HSD11B1ALDH1A1CYP2A6NPC1RAB9A | |
| SCHEMBL21662218 | 0.86 | CYP2A6 (0.54) | HSD11B1MAPK1ALDH1A1CYP2A6MAOB | |
| SCHEMBL21662351 | 0.84 | HSD11B1 (0.46) | HSD11B1MAPK1ALDH1A1CYP2A6MAOB | |
| SCHEMBL21662173 | 0.81 | HSD11B1 (0.43) | HSD11B1MAPK1ALDH1A1CYP2A6NPC1 | |
| SCHEMBL21662172 | 0.81 | ALDH1A1 (0.50) | HSD11B1MAPK1ALDH1A1CYP2A6MAOB | |
| SCHEMBL30125142 | 0.80 | MAOB (0.51) | HSD11B1MAPK1ALDH1A1CYP2A6MAOB | |
| SCHEMBL19794338 | 0.80 | MAOA (0.38) | MAPK1ALDH1A1CYP2A6MAOBMAOA | |
| SCHEMBL21662014 | 0.80 | ALDH1A1 (0.41) | HSD11B1MAPK1ALDH1A1CYP2A6NPC1 | |
| SCHEMBL21662228 | 0.78 | HSD11B1 (0.50) | HSD11B1MAPK1ALDH1A1CYP2A6MAOB | |
| SCHEMBL21662357 | 0.77 | MAPK1 (0.55) | HSD11B1MAPK1ALDH1A1CYP2A6MAOB |
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 | HSD11B1 4586/4885MAPK1 4452/4885ALDH1A1 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.