⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL95808 | 0.81 | — | — | |
| SCHEMBL1978922 | 0.78 | ALDH1A1 (0.50) | — | |
| SCHEMBL7555201 | 0.77 | ALDH1A1 (0.33) | — | |
| SCHEMBL9147547 | 0.77 | ALDH1A1 (0.33) | — | |
| SCHEMBL29017522 | 0.73 | — | — | |
| SCHEMBL10352085 | 0.72 | ALDH1A1 (0.44) | — | |
| SCHEMBL545420 | 0.72 | — | — | |
| SCHEMBL928138 | 0.72 | — | — | |
| SCHEMBL11772069 | 0.71 | — | — | |
| SCHEMBL1748936 | 0.71 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7713449-B2 | Polymer electrolytic material, polymer electrolytic part, membrane electrode assembly, and polymer electrolyte fuel cell | TORAY INDUSTRIES, INC. (JP) | 2010-05-11 | — | — | US | disclosed |
| WO-2008106334-A2 | FLAME RETARDED STYRENIC POLYMER FOAMS AND FOAM PRECURSORS | ALBEMARLE CORPORATION (US) | 2008-09-04 | — | — | WO | disclosed |
| CN-100364160-C | Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell | TORAY INDUSTRIES (JP) | 2008-01-23 | — | — | CN | disclosed |
| US-20060180796-A1 | Polymer electrolyte material, polymer electrolyte part, membrane electrode composite and polymer electrolyte type fuel cell | TORAY INDUSTRIES, INC. (JP) | 2006-08-17 | — | — | US | disclosed |
| EP-1619735-A1 | POLYMER ELECTROLYTE MATERIAL, POLYMER ELECTROLYTE PART, MEMBRANE ELECTRODE COMPOSITE AND POLYMER ELECTROLYTE TYPE FUEL CELL | TORAY INDUSTRIES, INC. (JP) | 2006-01-25 | — | — | EP | disclosed |
| US-4092292-A | HALOGEN-CONTAINING AMIDE | NATIONAL DISTILLERS AND CHEMICAL CORP. (US) | 1978-05-30 | — | — | US | disclosed |