⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29102714 | 0.70 | — | — | |
| SCHEMBL17626427 | 0.70 | — | — | |
| SCHEMBL20377365 | 0.67 | — | — | |
| SCHEMBL28098808 | 0.65 | — | — | |
| SCHEMBL8827976 | 0.65 | THRB (0.48) | — | |
| SCHEMBL28181597 | 0.64 | — | — | |
| SCHEMBL28818888 | 0.63 | — | — | |
| SCHEMBL4238236 | 0.61 | CYP3A4 (0.38) | — | |
| SCHEMBL258774 | 0.60 | — | — | |
| SCHEMBL186608 | 0.58 | — | — |
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-117039124-A | Lithium metal battery and preparation method thereof | 蜂巢能源科技股份有限公司 | 2023-11-10 | — | — | CN | disclosed |