⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24004637 | 0.85 | — | — | |
| SCHEMBL12050779 | 0.83 | — | — | |
| SCHEMBL12050780 | 0.83 | — | — | |
| SCHEMBL12050784 | 0.79 | ALDH1A1 (0.38) | — | |
| SCHEMBL12050783 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL12050786 | 0.79 | ALDH1A1 (0.38) | — | |
| SCHEMBL12050781 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL12050787 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL24004624 | 0.77 | — | — | |
| SCHEMBL24942615 | 0.76 | — | — |
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-4239745-A1 | LITHIUM ION BATTERY | Shenzhen Capchem Technology Co., Ltd. (CN) | 2023-09-06 | — | — | EP | disclosed |