⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2355179 | 0.84 | — | — | |
| SCHEMBL2059591 | 0.71 | — | — | |
| SCHEMBL7796366 | 0.69 | FDPS (0.34) | — | |
| SCHEMBL6064197 | 0.68 | TSHR (0.35) | — | |
| SCHEMBL28021691 | 0.67 | — | — | |
| SCHEMBL7153577 | 0.67 | FDPS (0.40) | — | |
| SCHEMBL3692897 | 0.66 | — | — | |
| SCHEMBL884189 | 0.65 | — | — | |
| Allylamine SCHEMBL18008491 | 0.64 | ALDH1A1 (0.33) | — | |
| SCHEMBL2517323 | 0.64 | — | — |
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-7981553-B2 | Nonaqueous electrolyte and lithium secondary battery employing the same | MITSUBISHI CHEMICAL CORPORATION (JP) | 2011-07-19 | — | — | US | disclosed |
| US-20100227226-A1 | NONAQUEOUS ELECTROLYTE AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2010-09-09 | — | — | US | disclosed |