⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11528590 | 1.00 | — | — | |
| SCHEMBL4791763 | 0.77 | — | — | |
| SCHEMBL7372237 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL9396950 | 0.74 | — | — | |
| SCHEMBL10386313 | 0.74 | ALDH1A1 (0.32) | — | |
| Bicarbonate SCHEMBL4337345 | 0.74 | — | — | |
| SCHEMBL5889094 | 0.72 | TSHR (0.42) | — | |
| SCHEMBL5889091 | 0.72 | TSHR (0.42) | — | |
| SCHEMBL22360472 | 0.72 | — | — | |
| SCHEMBL22350982 | 0.72 | DGAT1 (0.33) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118026845-A | Fluoroacetate compound | 大金工业株式会社 | 2024-05-14 | — | — | CN | disclosed |
| US-11945776-B2 | Electrolyte, electrochemical device, lithium ion secondary battery, and module | DAIKIN INDUSTRIES, LTD. (JP) | 2024-04-02 | — | — | US | disclosed |
| CN-111656595-B | Electrolyte, electrochemical device, lithium ion secondary battery and assembly | 大金工业株式会社 | 2024-01-05 | — | — | CN | disclosed |
| US-20210246098-A1 | ELECTROLYTE, ELECTROCHEMICAL DEVICE, LITHIUM ION SECONDARY BATTERY, AND MODULE | DAIKIN INDUSTRIES, LTD. (JP) | 2021-08-12 | — | — | US | disclosed |
| EP-3731328-A1 | ELECTROLYTE, ELECTROCHEMICAL DEVICE, LITHIUM ION SECONDARY BATTERY, AND MODULE | DAIKIN INDUSTRIES, LTD. (JP) | 2020-10-28 | — | — | EP | disclosed |
| CN-111656595-A | Electrolyte solution, electrochemical device, lithium ion secondary battery, and assembly | 大金工业株式会社 | 2020-09-11 | — | — | CN | disclosed |
| US-4150067-A | Metal-containing polymers, their manufacture and use | INSTITUT FRANCAIS DU PETROLE (FR) | 1979-04-17 | — | — | US | disclosed |
| US-4080490-A | Metal-containing polymers, their manufacture and use | INSTITUT FRANCAIS DU PETROLE (FR) | 1978-03-21 | — | — | US | disclosed |