Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PPIB | P23284 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTR2A | P28223 | 2/20 | 0.33 |
| ▸ | HTR2C | P28335 | 2/20 | 0.33 |
| ▸ | HTR2B | P41595 | 2/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.33 |
| ▸ | S100A4 | P26447 | 1/20 | 0.33 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL6806743 | 0.89 | L3MBTL1 (0.40) | PPIBALDH1A1CYP2D6L3MBTL1POLB | |
| SCHEMBL6796515 | 0.75 | ALDH1A1 (0.56) | ALDH1A1HSP90AA1HSP90AB1CYP2D6L3MBTL1 | |
| SCHEMBL30349347 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HSP90AA1HSP90AB1CYP2D6L3MBTL1 | |
| SCHEMBL132952 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HSP90AA1HSP90AB1CYP2D6L3MBTL1 | |
| SCHEMBL132951 | 0.74 | ALDH1A1 (0.41) | ALDH1A1HSP90AA1HSP90AB1CYP2D6L3MBTL1 | |
| SCHEMBL31096283 | 0.73 | ALDH1A1 (0.44) | ALDH1A1HSP90AA1HSP90AB1CYP2D6L3MBTL1 | |
| SCHEMBL6801274 | 0.69 | L3MBTL1 (0.44) | PPIBALDH1A1L3MBTL1POLBNPSR1 | |
| SCHEMBL1793005 | 0.67 | L3MBTL1 (0.46) | PPIBALDH1A1CYP2D6L3MBTL1POLB | |
| SCHEMBL29498104 | 0.67 | L3MBTL1 (0.46) | PPIBALDH1A1CYP2D6L3MBTL1POLB | |
| SCHEMBL6796508 | 0.67 | ALDH1A1 (0.46) | ALDH1A1HSP90AA1HSP90AB1CYP2D6L3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040082642-A1 | Novel estrogen receptor ligands and method III | MERCK & CO., INC. | 2004-04-29 | — | — | 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-20040082642-A1 | Novel estrogen receptor ligands and method III | ESRRA, ESRRB, FSHR | PPIB 1888/4885ALDH1A1 1752/4885HSP90AA1 2081/4885 |
“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.