⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21646767 | 1.00 | — | — | |
| SCHEMBL25507986 | 0.87 | — | — | |
| SCHEMBL19869343 | 0.83 | NLRP3 (0.32) | — | |
| SCHEMBL21646764 | 0.80 | NLRP3 (0.30) | — | |
| SCHEMBL25507493 | 0.73 | — | — | |
| SCHEMBL21646756 | 0.72 | — | — | |
| SCHEMBL23674551 | 0.72 | BCHE (0.32) | — | |
| SCHEMBL20692050 | 0.72 | BCHE (0.32) | — | |
| SCHEMBL21646540 | 0.72 | NLRP3 (0.32) | — | |
| SCHEMBL30041743 | 0.72 | BCHE (0.32) | — |
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-20230159555-A1 | SULFONIMIDAMIDE COMPOUNDS AS NLRP3 MODULATORS | GENENTECH, INC. (US) | 2023-05-25 | — | — | US | disclosed |