⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5022875 | 0.78 | — | — | |
| SCHEMBL5013413 | 0.78 | PTGS1 (0.33) | — | |
| SCHEMBL5015021 | 0.78 | — | — | |
| SCHEMBL5014573 | 0.75 | — | — | |
| SCHEMBL5014564 | 0.72 | TP53 (0.33) | — | |
| SCHEMBL5016883 | 0.69 | ALDH1A1 (0.31) | — | |
| SCHEMBL10707834 | 0.67 | — | — | |
| SCHEMBL8759701 | 0.67 | — | — | |
| SCHEMBL656000 | 0.65 | — | — | |
| SCHEMBL4300078 | 0.65 | CA5A (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111971841-A | Nonaqueous electrolyte for electricity storage device | 富山药品工业株式会社 | 2020-11-20 | — | — | CN | disclosed |
| US-8404389-B2 | solvent of the electrolytic solution contains a sulfone compound such as or bis(trimethylsilyl)methanedisulfonate or other sulfonate-silane compounds; chemical stability of the electrolytic solution is improved | SONY CORPORATION (JP) | 2013-03-26 | — | — | US | disclosed |
| US-20080138715-A1 | ELECTROLYTIC SOLUTION AND BATTERY | SONY CORPORATION (JP) | 2008-06-12 | — | — | US | disclosed |