Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.55 |
| ▸ | ADH1C | P00326 | 1/20 | 0.55 |
| ▸ | ADH1A | P07327 | 1/20 | 0.55 |
| ▸ | ADH7 | P40394 | 1/20 | 0.55 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | CCNE1 | P24864 | 3/20 | 0.43 |
| ▸ | CDK2 | P24941 | 3/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.43 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.42 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.42 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.42 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.42 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL14957567 | 0.82 | CYP1A2 (0.47) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL16781356 | 0.81 | CXCR4 (0.50) | HCAR2CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL933590 | 0.80 | CYP1A2 (0.47) | HCAR2CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL18179877 | 0.79 | MAOA (0.52) | CYP2D6CYP1A2CYP19A1CYP2C9CYP2C19 | |
| SCHEMBL3517425 | 0.79 | CA12 (0.48) | HCAR2CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL2237883 | 0.78 | ADRB2 (0.51) | HCAR2CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL3722162 | 0.78 | IDO1 (0.50) | HCAR2CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL27607143 | 0.77 | CA12 (0.47) | HCAR2CYP2D6CYP1A2CYP19A1CYP2C9 | |
| SCHEMBL1691160 | 0.77 | ADH1B (0.76) | ADH1BADH1CADH1AADH7CYP2D6 | |
| SCHEMBL5451697 | 0.77 | ADH1B (0.76) | ADH1BADH1CADH1AADH7CYP2D6 |
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-20060287378-A1 | Novel pyrroles and imidazoles | WARNER-LAMBERT COMPANY LLC | 2006-12-21 | — | — | US | disclosed |
| US-20050239857-A1 | Novel imidazoles | BOLTON GARY L | 2005-10-27 | — | — | 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 (2 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-20060287378-A1 | Novel pyrroles and imidazoles | PPIP5K2, PPIE, PPOX | ADH1B 883/4885ADH1C 336/4885ADH1A 293/4885 |
| US-20050239857-A1 | Novel imidazoles | HMGCR, HMGB2, HMGB3 | ADH1B 68/4885ADH1C 426/4885ADH1A 304/4885 |
“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.