⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL778330 | 0.78 | — | — | |
| SCHEMBL14775613 | 0.75 | APEX1 (0.30) | — | |
| SCHEMBL3167161 | 0.75 | GAA (0.34) | — | |
| SCHEMBL10493348 | 0.71 | TP53 (0.44) | — | |
| SCHEMBL24022726 | 0.69 | — | — | |
| SCHEMBL4127744 | 0.69 | GRIA1 (0.31) | — | |
| SCHEMBL5928307 | 0.69 | — | — | |
| SCHEMBL9274278 | 0.69 | GCLC (0.35) | — | |
| SCHEMBL21371916 | 0.69 | GCLC (0.31) | — | |
| SCHEMBL24685102 | 0.68 | — | — |
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-8758946-B2 | Electrolyte suitable for use in a lithium ion cell or battery | GINER, INC. (US) | 2014-06-24 | — | — | US | disclosed |
| US-20080193855-A1 | A lithium salt, a lithium ion solvating solvent; and fluorinated solvent; high dielectric constant, a low viscosity and a high flashpoint | GINER, INC. | 2008-08-14 | — | — | US | disclosed |