⚠ 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 | |
|---|---|---|---|---|
| Butadiene SCHEMBL1227609 | 0.92 | — | — | |
| Vinyl Chloride SCHEMBL27951730 | 0.83 | — | — | |
| Propene SCHEMBL27512018 | 0.80 | — | — | |
| Butadiene SCHEMBL17498998 | 0.79 | — | — | |
| SCHEMBL28054014 | 0.78 | — | — | |
| Ethylene SCHEMBL27290856 | 0.76 | — | — | |
| Chloromethane SCHEMBL27825881 | 0.76 | — | — | |
| SCHEMBL109023 | 0.76 | — | — | |
| Ethyl Chloride SCHEMBL28057710 | 0.74 | — | — | |
| Ethylene SCHEMBL28074749 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0735163-B1 | Electroconductive conjugate fiber | TEIJIN LTD (JP) | 1999-01-27 | — | — | EP | disclosed |
| US-5654096-A | MULTICOMPONENT FILAMENTS COMPRISING METALLIC INORGANIC CORE PARTICLES DISPERSING IN A THERMOPLASTIC RESIN, THE CORE SURFACE TREATED SILANE COMPOUND | TEIJIN LIMITED (JP) | 1997-08-05 | — | — | US | disclosed |
| EP-0735163-A1 | Electroconductive conjugate fiber | TEIJIN LIMITED (JP) | 1996-10-02 | — | — | EP | disclosed |