⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2138676 | 0.85 | NLRP3 (0.31) | — | |
| SCHEMBL4073653 | 0.76 | — | — | |
| SCHEMBL26299420 | 0.76 | NLRP3 (0.52) | — | |
| SCHEMBL4006475 | 0.74 | — | — | |
| SCHEMBL2485105 | 0.74 | — | — | |
| SCHEMBL1015884 | 0.73 | NLRP3 (0.30) | — | |
| SCHEMBL775870 | 0.73 | — | — | |
| Propane SCHEMBL8719519 | 0.72 | NLRP3 (0.37) | — | |
| SCHEMBL2017460 | 0.70 | CNR2 (0.32) | — | |
| SCHEMBL11928255 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-10381681-B2 | Electrolyte and lithium-ion battery containing the same | CONTEMPORARY AMPEREX TECHNOLOGY CO., LIMITED (CN) | 2019-08-13 | — | — | US | disclosed |
| US-20170346132-A1 | ELECTROLYTE AND LITHIUM-ION BATTERY CONTAINING THE SAME | CONTEMPORARY AMPEREX TECHNOLOGY (HONG KONG) LIMITED (CN) | 2017-11-30 | — | — | US | disclosed |