⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10213112 | 1.00 | — | — | |
| SCHEMBL23114277 | 0.97 | L3MBTL1 (0.33) | — | |
| SCHEMBL2758654 | 0.97 | L3MBTL1 (0.33) | — | |
| SCHEMBL24536431 | 0.97 | L3MBTL1 (0.33) | — | |
| SCHEMBL24247364 | 0.84 | — | — | |
| SCHEMBL23664792 | 0.84 | — | — | |
| SCHEMBL13895317 | 0.84 | — | — | |
| SCHEMBL24972030 | 0.84 | — | — | |
| SCHEMBL21216367 | 0.84 | — | — | |
| SCHEMBL24918657 | 0.82 | — | — |
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-9926299-B2 | Inhibitors of bruton's tyrosine kinase | CENTAURUS BIOPHARMA CO., LTD. (CN) | 2018-03-27 | — | — | US | disclosed |