⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20216144 | 0.65 | — | — | |
| SCHEMBL12891027 | 0.64 | — | — | |
| SCHEMBL21956005 | 0.63 | ALDH1A1 (0.44) | — | |
| SCHEMBL20690142 | 0.63 | — | — | |
| SCHEMBL21147075 | 0.63 | — | — | |
| SCHEMBL13799172 | 0.63 | TET2 (0.34) | — | |
| SCHEMBL19117753 | 0.63 | — | — | |
| SCHEMBL22763470 | 0.62 | TDP1 (0.36) | — | |
| SCHEMBL25122093 | 0.62 | — | — | |
| SCHEMBL19144497 | 0.62 | — | — |
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-20210214362-A1 | FUSED BICYCLIC COMPOUNDS FOR THE TREATMENT OF DISEASE | AKARNA THERAPEUTICS, LTD. (GB) | 2021-07-15 | — | — | US | disclosed |