⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6449463 | 0.88 | — | — | |
| SCHEMBL11877444 | 0.86 | — | — | |
| SCHEMBL22193635 | 0.83 | — | — | |
| SCHEMBL25568270 | 0.77 | — | — | |
| SCHEMBL25568273 | 0.77 | — | — | |
| SCHEMBL12021179 | 0.77 | GRIN2D (0.33) | — | |
| SCHEMBL11051296 | 0.75 | GRIN2D (0.33) | — | |
| SCHEMBL19366310 | 0.72 | — | — | |
| SCHEMBL20064121 | 0.72 | GNAI3 (0.37) | — | |
| SCHEMBL419710 | 0.71 | — | — |
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-3725771-A1 | ALK PROTEIN DEGRADATION AGENT AND ANTI-TUMOR APPLICATION THEREOF | Shanghaitech University (CN) | 2020-10-21 | — | — | EP | disclosed |