⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26373441 | 1.00 | — | — | |
| SCHEMBL18883518 | 0.87 | PIK3CD (0.31) | — | |
| SCHEMBL887933 | 0.78 | — | — | |
| SCHEMBL24325586 | 0.78 | — | — | |
| SCHEMBL27900322 | 0.78 | CYP2A6 (0.30) | — | |
| SCHEMBL9926898 | 0.76 | — | — | |
| SCHEMBL18518005 | 0.76 | — | — | |
| SCHEMBL24906736 | 0.76 | — | — | |
| SCHEMBL15694834 | 0.76 | — | — | |
| SCHEMBL18597590 | 0.76 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2021257568-A1 | ANAPLASTIC LYMPHOMA KINASE (ALK) iRNA AGENT COMPOSITIONS AND METHODS OF USE THEREOF | ALNYLAM PHARMACEUTICALS, INC. (US) | 2021-12-23 | — | — | WO | disclosed |