⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24728918 | 0.62 | — | — | |
| SCHEMBL23437895 | 0.57 | — | — | |
| SCHEMBL26375601 | 0.56 | KDM4E (0.31) | — | |
| SCHEMBL3213071 | 0.56 | — | — | |
| SCHEMBL7916442 | 0.56 | — | — | |
| SCHEMBL25081718 | 0.55 | — | — | |
| SCHEMBL19287727 | 0.55 | — | — | |
| SCHEMBL24062637 | 0.55 | — | — | |
| SCHEMBL23513077 | 0.54 | — | — | |
| SCHEMBL22268222 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20230011652-A1 | COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH NLRP ACTIVITY | NOVARTIS AG (CH) | 2023-01-12 | — | — | US | disclosed |