Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | HTR1D | P28221 | 2/20 | 0.45 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | HTR7 | P34969 | 1/20 | 0.41 |
| ▸ | PPARA | Q07869 | 1/20 | 0.40 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 3/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 2/20 | 0.36 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.36 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.36 |
| ▸ | PDGFRA | P16234 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6663147 | 0.90 | CYP2A6 (0.50) | CYP2A6CYP3A4CYP2C9CYP2B6CYP2C19 | |
| SCHEMBL6844272 | 0.85 | HTR6 (0.50) | CYP2A6CYP3A4HTR1DHTR6MAPT | |
| SCHEMBL6846150 | 0.84 | HTR1D (0.55) | CYP2A6CYP3A4HTR1DMAPTCYP19A1 | |
| SCHEMBL6846114 | 0.82 | HTR1D (0.48) | HTR1DHTR6MAPTCYP19A1CYP11B1 | |
| SCHEMBL6658140 | 0.80 | CYP19A1 (0.55) | CYP3A4HTR1DHTR6MAPTNPC1 | |
| SCHEMBL6661324 | 0.79 | HTR1D (0.46) | CYP2A6CYP3A4CYP2C9CYP2B6CYP2C19 | |
| SCHEMBL6659322 | 0.78 | HTR1D (0.47) | CYP2A6CYP3A4HTR1DMAPTCYP19A1 | |
| SCHEMBL6660867 | 0.78 | MAPT (0.46) | HTR1DMAPTCYP19A1CYP11B1CYP11B2 | |
| SCHEMBL6846000 | 0.77 | CDC7 (0.43) | HTR1DHTR6MAPTNPC1CYP19A1 | |
| SCHEMBL6844445 | 0.77 | CYP2A6 (0.47) | CYP2A6CYP3A4CYP2C9CYP2B6CYP2C19 |
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-20040236110-A1 | Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors | BAYER PHARMACEUTICALS CORPORATION | 2004-11-25 | — | — | 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-20040236110-A1 | Substituted 3-pyridyl indoles and indazoles as c17,20 lyase inhibitors | CYP17A1, IDO1, CYP21A2 | CYP2A6 182/4885CYP3A4 98/4885CYP2C9 55/4885 |
“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.