⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28648555 | 1.00 | — | — | |
| SCHEMBL28694323 | 0.89 | — | — | |
| SCHEMBL27467744 | 0.89 | — | — | |
| SCHEMBL28446436 | 0.87 | — | — | |
| SCHEMBL15954092 | 0.87 | — | — | |
| SCHEMBL28726441 | 0.87 | — | — | |
| SCHEMBL28506124 | 0.87 | — | — | |
| SCHEMBL28868358 | 0.87 | — | — | |
| SCHEMBL109991 | 0.87 | — | — | |
| SCHEMBL27909736 | 0.87 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113611817-A | Preparation method of immersed aluminum-air battery with negative electrode recovery device | 北京理工大学 | 2021-11-05 | — | — | CN | disclosed |