⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10754207 | 0.65 | — | — | |
| SCHEMBL9662891 | 0.64 | — | — | |
| SCHEMBL31555073 | 0.63 | ALOX15 (0.41) | — | |
| SCHEMBL30070564 | 0.60 | — | — | |
| SCHEMBL535011 | 0.60 | — | — | |
| SCHEMBL10964095 | 0.58 | ALOX15 (0.36) | — | |
| SCHEMBL8565178 | 0.58 | MAOA (0.35) | — | |
| SCHEMBL18533018 | 0.56 | — | — | |
| SCHEMBL31091494 | 0.56 | — | — | |
| SCHEMBL10711509 | 0.55 | — | — |
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-117616030-A | Orexin receptor agonists and uses thereof | 爵士制药爱尔兰有限公司 | 2024-02-27 | — | — | CN | disclosed |
| WO-2007084721-A2 | SKIN PROTECTION AND MOISTURIZING COMPOSITIONS AND METHODS | SAKURA PROPERTIES, LLC (US) | 2007-07-26 | — | — | WO | disclosed |