⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5485879 | 0.96 | — | — | |
| SCHEMBL27735699 | 0.79 | — | — | |
| SCHEMBL5484027 | 0.78 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL5983546 | 0.78 | ALDH1A1 (0.41) | — | |
| SCHEMBL28861769 | 0.75 | LMNA (0.33) | — | |
| SCHEMBL5483278 | 0.74 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL1519445 | 0.72 | TSHR (0.60) | — | |
| SCHEMBL2005290 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL28780968 | 0.71 | ALDH1A1 (0.61) | — | |
| SCHEMBL394297 | 0.69 | TSHR (0.30) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120244414-A1 | NONAQUEOUS ELECTROLYTE BATTERY AND BATTERY PACK | KABUSHIKI KAISHA TOSHIBA (JP) | 2012-09-27 | — | — | US | disclosed |
| EP-1037293-B1 | Non-aqueous electrolyte and lithium secondary battery using the same | SUMITOMO CHEMICAL CO (JP) | 2007-05-16 | — | — | EP | disclosed |
| US-6379846-B1 | ORGANO(POLY)PHOSPHORIC ACID WITH HYDROGEN REPLACED BY TRIHYDROCARBYL SILICON, GERMANIUM OR TIN; HIGH ENERGY DENSITY | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2002-04-30 | — | — | US | disclosed |
| EP-1037293-A1 | Non-aqueous electrolyte and lithium secondary battery using the same | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-09-20 | — | — | EP | disclosed |