⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1313893 | 0.76 | — | — | |
| SCHEMBL20423435 | 0.76 | — | — | |
| SCHEMBL15005632 | 0.74 | — | — | |
| SCHEMBL15005330 | 0.74 | — | — | |
| SCHEMBL14655859 | 0.71 | — | — | |
| SCHEMBL28893408 | 0.70 | ALDH1A1 (0.31) | — | |
| SCHEMBL11576735 | 0.69 | — | — | |
| SCHEMBL25381775 | 0.69 | MEN1 (0.31) | — | |
| SCHEMBL29250360 | 0.68 | — | — | |
| SCHEMBL10276775 | 0.67 | KDM4E (0.35) | — |
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-116583980-A | Electrolyte composition for lithium metal battery | 索尔维公司 | 2023-08-11 | — | — | CN | claimed |
| CN-116583980-A | Electrolyte composition for lithium metal battery | 索尔维公司 | 2023-08-11 | — | — | CN | disclosed |