⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16055785 | 0.97 | — | — | |
| SCHEMBL4667202 | 0.86 | — | — | |
| SCHEMBL15923194 | 0.82 | — | — | |
| SCHEMBL5985759 | 0.76 | RAB9A (0.41) | — | |
| SCHEMBL5985954 | 0.76 | RAB9A (0.41) | — | |
| SCHEMBL5985508 | 0.76 | RAB9A (0.41) | — | |
| SCHEMBL5985819 | 0.76 | RAB9A (0.41) | — | |
| SCHEMBL5984971 | 0.76 | RAB9A (0.41) | — | |
| SCHEMBL5984830 | 0.76 | RAB9A (0.41) | — | |
| SCHEMBL5984107 | 0.76 | RAB9A (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021211436-A1 | IDEBENONE COMPOUNDS | TRAVECTA THERAPEUTICS PTE. LTD. (SG) | 2021-10-21 | — | — | WO | disclosed |