⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12182899 | 0.69 | — | — | |
| SCHEMBL14781607 | 0.68 | — | — | |
| SCHEMBL12182990 | 0.67 | — | — | |
| SCHEMBL15127892 | 0.63 | — | — | |
| SCHEMBL12183008 | 0.62 | — | — | |
| SCHEMBL12182866 | 0.60 | — | — | |
| SCHEMBL14786780 | 0.56 | — | — | |
| SCHEMBL14787307 | 0.56 | — | — | |
| SCHEMBL14786725 | 0.55 | — | — | |
| SCHEMBL14781901 | 0.54 | SMN1; SMN2 (0.43) | — |
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-2011142410-A1 | NON-AQUEOUS ELECTROLYTIC SOLUTION, AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY | 三菱化学株式会社 (JP) | 2011-11-17 | — | — | WO | disclosed |