⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7164679 | 1.00 | — | — | |
| SCHEMBL625852 | 1.00 | — | — | |
| SCHEMBL11263673 | 0.95 | ALDH1A1 (0.58) | — | |
| SCHEMBL11263667 | 0.95 | ALDH1A1 (0.58) | — | |
| Carbon Monoxide SCHEMBL5590548 | 0.84 | ALDH1A1 (0.47) | — | |
| SCHEMBL6932498 | 0.82 | — | — | |
| SCHEMBL13464673 | 0.82 | — | — | |
| SCHEMBL21637609 | 0.82 | — | — | |
| SCHEMBL6932497 | 0.82 | — | — | |
| SCHEMBL3039781 | 0.82 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116190792-A | Electrolyte additive, electrolyte and lithium ion battery | 浙江大学杭州国际科创中心 | 2023-05-30 | — | — | CN | claimed |
| CN-116190792-A | Electrolyte additive, electrolyte and lithium ion battery | 浙江大学杭州国际科创中心 | 2023-05-30 | — | — | CN | disclosed |