⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15967557 | 0.71 | — | — | |
| SCHEMBL8677609 | 0.69 | — | — | |
| SCHEMBL4425363 | 0.68 | — | — | |
| SCHEMBL13005191 | 0.68 | — | — | |
| SCHEMBL14369286 | 0.66 | EPHX1 (0.33) | — | |
| SCHEMBL16389147 | 0.64 | EPHX1 (0.36) | — | |
| SCHEMBL12345767 | 0.63 | EPHX1 (0.44) | — | |
| SCHEMBL13005185 | 0.62 | KDM4E (0.33) | — | |
| SCHEMBL11444699 | 0.62 | PRSS1 (0.30) | — | |
| SCHEMBL353546 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023000889-A1 | NON-AQUEOUS ELECTROLYTE AND LITHIUM-ION BATTERY | 深圳新宙邦科技股份有限公司 | 2023-01-26 | — | — | WO | disclosed |