⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19700375 | 0.71 | — | — | |
| SCHEMBL21469298 | 0.68 | — | — | |
| SCHEMBL24246574 | 0.59 | — | — | |
| SCHEMBL25328143 | 0.57 | — | — | |
| SCHEMBL26058798 | 0.56 | ALDH1A1 (0.30) | — | |
| SCHEMBL18849756 | 0.56 | — | — | |
| SCHEMBL18884047 | 0.56 | — | — | |
| SCHEMBL9968610 | 0.56 | — | — | |
| SCHEMBL18883827 | 0.56 | — | — | |
| SCHEMBL9968615 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10793576-B2 | Compound used as Bruton's tyrosine kinase inhibitor and preparation method and application thereof | CHENGDU BRILLIANT PHARMACEUTICAL CO., LTD. (CN) | 2020-10-06 | — | — | US | disclosed |
| US-20190315758-A1 | COMPOUND USED AS BRUTON'S TYROSINE KINASE INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF | CHENGDU BRILLIANT PHARMACEUTICAL CO., LTD. (CN) | 2019-10-17 | — | — | US | disclosed |