Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.46 |
| ▸ | GRM2 | Q14416 | 10/20 | 0.39 |
| ▸ | OXER1 | Q8TDS5 | 1/20 | 0.37 |
| ▸ | CDK4 | P11802 | 3/20 | 0.37 |
| ▸ | CCND1 | P24385 | 3/20 | 0.37 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.36 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.36 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL15676807 | 0.85 | BACE1 (0.48) | BACE1OXER1CDK4CCND1GABRA1 | |
| SCHEMBL5446561 | 0.83 | BACE1 (0.45) | BACE1OXER1CDK4CCND1GABRA1 | |
| SCHEMBL11005480 | 0.79 | CMA1 (0.48) | BACE1OXER1CDK4CCND1GABRA1 | |
| SCHEMBL12384269 | 0.79 | SLC6A4 (0.39) | GRM2CDK4CCND1CNR2 | |
| SCHEMBL1696643 | 0.78 | APP (0.50) | BACE1 | |
| SCHEMBL28990233 | 0.78 | OXER1 (0.46) | BACE1OXER1CDK4CCND1CNR2 | |
| SCHEMBL14397085 | 0.77 | BACE1 (0.45) | BACE1OXER1GABRA1GABRB2 | |
| SCHEMBL28577320 | 0.76 | CDK4 (0.39) | BACE1GRM2CDK4CCND1CNR2 | |
| SCHEMBL6085455 | 0.76 | BACE1 (0.47) | BACE1 | |
| SCHEMBL1696888 | 0.75 | OXER1 (0.40) | BACE1OXER1CDK4CCND1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-115838348-B | Synthesis method and application of benzopyrrole quaternary ammonium base | 万华化学集团股份有限公司 | 2024-11-12 | — | — | CN | disclosed |
| CN-115838348-A | Synthetic method and application of benzopyrrole quaternary ammonium hydroxide | 万华化学集团股份有限公司 | 2023-03-24 | — | — | CN | disclosed |