⚠ 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 | |
|---|---|---|---|---|
| Ethylene SCHEMBL249833 | 0.95 | — | — | |
| SCHEMBL29689437 | 0.91 | — | — | |
| SCHEMBL8024463 | 0.91 | — | — | |
| Fluoride SCHEMBL28220692 | 0.86 | — | — | |
| SCHEMBL9788071 | 0.85 | — | — | |
| SCHEMBL28246359 | 0.82 | — | — | |
| SCHEMBL3919064 | 0.80 | — | — | |
| Ethane SCHEMBL5566430 | 0.80 | — | — | |
| Ethane SCHEMBL5052383 | 0.80 | — | — | |
| Water SCHEMBL639453 | 0.80 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120065319-A1 | Elastomer Compositions Modified By Silanes | DOW CORNING EUROPE SA (BE) | 2012-03-15 | — | — | US | disclosed |