⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19532101 | 0.77 | — | — | |
| SCHEMBL19532100 | 0.77 | — | — | |
| SCHEMBL577133 | 0.77 | — | — | |
| SCHEMBL29970023 | 0.77 | — | — | |
| SCHEMBL28371256 | 0.72 | SMN1; SMN2 (0.31) | — | |
| SCHEMBL8049330 | 0.69 | — | — | |
| SCHEMBL13502520 | 0.68 | — | — | |
| SCHEMBL25701267 | 0.68 | — | — | |
| SCHEMBL2759295 | 0.67 | MEN1 (0.31) | — | |
| SCHEMBL20208292 | 0.67 | MEN1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6479192-B1 | NON-AQUEOUS ELECTROLYTE COMPRISES A SOLVENT MIXTURE OF THE TRANS-4,5-DIALKYL-1,3-DIOXOLANE-2-ONE; ETHYLENE CARBONATE; AND A LINEAR CARBONATE | LG CHEMICAL LTD. (KR) | 2002-11-12 | — | — | US | disclosed |