⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26955030 | 0.84 | — | — | |
| SCHEMBL22456147 | 0.81 | — | — | |
| SCHEMBL21280277 | 0.79 | — | — | |
| SCHEMBL23988151 | 0.76 | — | — | |
| SCHEMBL24798560 | 0.74 | — | — | |
| SCHEMBL23119603 | 0.74 | PRMT3 (0.41) | — | |
| SCHEMBL23988540 | 0.74 | — | — | |
| SCHEMBL21973804 | 0.74 | — | — | |
| SCHEMBL15047185 | 0.73 | — | — | |
| SCHEMBL16090746 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3336090-B1 | IRAK4 INHIBITOR AND USE THEREOF | BEIJING HANMI PHARMACEUTICAL CO LTD (CN) | 2020-07-22 | — | — | EP | disclosed |