⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL654628 | 0.81 | — | — | |
| SCHEMBL27958418 | 0.80 | — | — | |
| SCHEMBL11548991 | 0.77 | — | — | |
| SCHEMBL820470 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL11548988 | 0.77 | — | — | |
| SCHEMBL820469 | 0.77 | ALDH1A1 (0.30) | — | |
| SCHEMBL28571185 | 0.75 | THRB (0.37) | — | |
| SCHEMBL14013858 | 0.73 | TSHR (0.31) | — | |
| SCHEMBL10939609 | 0.73 | TSHR (0.31) | — | |
| SCHEMBL38387 | 0.73 | TSHR (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116315114-A | High-voltage low-salt concentration sodium ion electrolyte and preparation method thereof | 河南省法恩莱特新能源科技有限公司 | 2023-06-23 | — | — | CN | claimed |
| CN-116315114-A | High-voltage low-salt concentration sodium ion electrolyte and preparation method thereof | 河南省法恩莱特新能源科技有限公司 | 2023-06-23 | — | — | CN | disclosed |
| CN-114914536-A | Electrolyte for lithium battery, and method for improving performance of high-temperature lithium battery | 中国科学院物理研究所 | 2022-08-16 | — | — | CN | disclosed |
| US-20120045698-A1 | NON-AQUEOUS LIQUID ELECTROLYTE AND NON-AQUEOUS LIQUID ELECTROLYTE SECONDARY BATTERY USING THE SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2012-02-23 | — | — | US | disclosed |