⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12153628 | 0.71 | — | — | |
| Methyl Alcohol SCHEMBL9569311 | 0.67 | — | — | |
| SCHEMBL1930991 | 0.64 | P2RY6 (0.41) | — | |
| SCHEMBL9088717 | 0.60 | — | — | |
| SCHEMBL14751607 | 0.59 | — | — | |
| SCHEMBL16992630 | 0.50 | — | — | |
| SCHEMBL9408954 | 0.50 | — | — | |
| SCHEMBL14892844 | 0.46 | — | — | |
| SCHEMBL6520634 | 0.46 | — | — | |
| SCHEMBL9302088 | 0.45 | — | — |
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-7989109-B2 | Organic electrolytic solution and lithium battery employing the same | SAMSUNG SDI CO., LTD. (KR) | 2011-08-02 | — | — | US | disclosed |