⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5963403 | 0.87 | — | — | |
| SCHEMBL5963358 | 0.85 | — | — | |
| SCHEMBL5964229 | 0.84 | — | — | |
| SCHEMBL5963407 | 0.84 | — | — | |
| SCHEMBL5963935 | 0.84 | — | — | |
| Water SCHEMBL27993919 | 0.75 | — | — | |
| SCHEMBL15697846 | 0.74 | — | — | |
| SCHEMBL16301170 | 0.74 | — | — | |
| SCHEMBL19102833 | 0.74 | — | — | |
| SCHEMBL5963442 | 0.74 | DGAT1 (0.32) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20060172201-A1 | Non-aqueous electrolyte and lithium secondary battery using the same | MITSUBISHI CHEMICAL CORPORATION (JP) | 2006-08-03 | — | — | US | disclosed |
| EP-1357628-A1 | NONAQUEOUS ELECTROLYTIC LIQUIDS AND LITHIUM SECONDARY BATTERY EMPLOYING THE SAME | MITSUBISHI CHEMICAL CORPORATION (JP) | 2003-10-29 | — | — | EP | disclosed |
| US-4345002-A | CYCLIC NITROGEN COMPOUND, HYDROXY CONTAINING ORGANO-PHOSPHORUS COMPOUND, AND A PHOSPHORUS CONTAINING ACID | GREAT LAKES CHEMICAL CORPORATION (US) | 1982-08-17 | — | — | US | disclosed |
| US-4241145-A | TRIAMINO-TRIAZINE, COPOLYCONDENSED VINYLPHOSPHONATE, A PHOSPHORUS-CONTAINING ACID AND WATER FIREPROOF WOOD SUBSTRATES | VELSICOL CHEMICAL CORPORATION (US) | 1980-12-23 | — | — | US | disclosed |
| US-4221837-A | MELAMINE DERAVITIVE, PHOSPHORUS POLYOL, ORGANOPHOSPHORUS ACID | VELSICOL CHEMICAL CORPORATION (US) | 1980-09-09 | — | — | US | disclosed |
| US-4210452-A | Novel intumescent composition | Veesicol Chemical Corporation (US) | 1980-07-01 | — | — | US | disclosed |
| EP-0008939-A2 | Intumescent composition | GREAT LAKES CHEMICAL CORPORATION (US) | 1980-03-19 | — | — | EP | disclosed |