⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL31556662 | 0.87 | ESRRA (0.31) | — | |
| SCHEMBL31556557 | 0.86 | MPO (0.33) | — | |
| SCHEMBL31556589 | 0.86 | MPO (0.33) | — | |
| SCHEMBL31556623 | 0.86 | — | — | |
| SCHEMBL31556563 | 0.86 | — | — | |
| SCHEMBL31556547 | 0.86 | — | — | |
| SCHEMBL31556612 | 0.86 | — | — | |
| SCHEMBL31556635 | 0.79 | MEN1 (0.36) | — | |
| SCHEMBL31556545 | 0.73 | MPO (0.35) | — | |
| SCHEMBL31556586 | 0.73 | MPO (0.35) | — |
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-119894896-A | Inhibitors of green peroxidase | 阿斯利康(瑞典)有限公司 | 2025-04-25 | — | — | CN | claimed |
| CN-119894896-A | Inhibitors of green peroxidase | 阿斯利康(瑞典)有限公司 | 2025-04-25 | — | — | CN | disclosed |