⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11116364 | 0.69 | — | — | |
| SCHEMBL4412627 | 0.63 | — | — | |
| SCHEMBL10815149 | 0.61 | — | — | |
| SCHEMBL136590 | 0.61 | — | — | |
| SCHEMBL4299813 | 0.61 | TSHR (0.39) | — | |
| SCHEMBL14280856 | 0.59 | — | — | |
| SCHEMBL21833398 | 0.59 | — | — | |
| Ethylene SCHEMBL1470482 | 0.59 | — | — | |
| SCHEMBL1727714 | 0.59 | — | — | |
| SCHEMBL11104666 | 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-110943250-B | Electrolyte and lithium ion battery containing electrolyte | 宁德新能源科技有限公司 | 2021-09-24 | — | — | CN | disclosed |