⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14772901 | 0.84 | — | — | |
| SCHEMBL12820958 | 0.77 | — | — | |
| SCHEMBL12979232 | 0.75 | — | — | |
| SCHEMBL13862108 | 0.74 | TDP1 (0.30) | — | |
| SCHEMBL22808891 | 0.74 | — | — | |
| SCHEMBL11984277 | 0.71 | — | — | |
| SCHEMBL23914126 | 0.69 | — | — | |
| SCHEMBL10331578 | 0.69 | — | — | |
| SCHEMBL19681523 | 0.67 | — | — | |
| SCHEMBL10236223 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020125615-A1 | C-TERMINAL SRC KINASE INHIBITORS | INVENTISBIO SHANGHAI LTD. (CN) | 2020-06-25 | — | — | WO | disclosed |
| EP-2380881-B1 | NOVEL BICYCLIC HETEROCYCLIC COMPOUND | SUMITOMO DAINIPPON PHARMA CO LTD (JP) | 2017-01-25 | — | — | EP | disclosed |