Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 4/20 | 0.62 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.62 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.60 |
| ▸ | MKNK2 | Q9HBH9 | 3/20 | 0.60 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.60 |
| ▸ | AXL | P30530 | 1/20 | 0.60 |
| ▸ | CYP11B2 | P19099 | 5/20 | 0.53 |
| ▸ | CYP11B1 | P15538 | 4/20 | 0.53 |
| ▸ | CYP19A1 | P11511 | 3/20 | 0.53 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.53 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.53 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.53 |
| ▸ | KMO | O15229 | 1/20 | 0.53 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL24492814 | 1.00 | CYP2A6 (0.62) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL16577179 | 1.00 | CYP2A6 (0.62) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL22428539 | 1.00 | CYP2A6 (0.62) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL17694301 | 1.00 | CYP2A6 (0.62) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL19817613 | 0.98 | CYP2A6 (0.65) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL18650155 | 0.96 | CYP19A1 (0.59) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL24492856 | 0.96 | CYP19A1 (0.59) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL18650154 | 0.96 | CYP19A1 (0.59) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL12070033 | 0.96 | CYP2A6 (0.68) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 | |
| SCHEMBL12068188 | 0.96 | CYP2A6 (0.68) | CYP2A6CYP3A4ALDH1A1CYP1A2MKNK1 |
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-20220177454-A1 | TRISUBSTITUTED BENZENE COMPOUND HAVING NITROGEN-CONTAINING HETERO RING IN MOLECULAR TERMINUS AND ORGANIC ELECTROLUMINESCENCE ELEMENT | HODOGAYA CHEMICAL CO., LTD. (JP) | 2022-06-09 | — | — | US | disclosed |
| WO-2020184379-A1 | TRISUBSTITUTED BENZENE COMPOUND HAVING NITROGEN-CONTAINING HETERO RING IN MOLECULAR TERMINUS AND ORGANIC ELECTROLUMINESCENCE ELEMENT | 保土谷化学工業株式会社 | 2020-09-17 | — | — | WO | 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-20220177454-A1 | TRISUBSTITUTED BENZENE COMPOUND HAVING NITROGEN-CONTAINING HETERO RING IN MOLECULAR TERMINUS AND ORGANIC ELECTROLUMINESCENCE ELEMENT | ETV6, LEF1, TEAD2 | CYP2A6 2586/4885CYP3A4 1434/4885ALDH1A1 1888/4885 |
“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.