⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4089577 | 0.72 | — | — | |
| SCHEMBL486242 | 0.72 | — | — | |
| SCHEMBL5014859 | 0.67 | — | — | |
| SCHEMBL9567257 | 0.67 | — | — | |
| SCHEMBL9130121 | 0.64 | — | — | |
| SCHEMBL8687890 | 0.63 | — | — | |
| SCHEMBL5014823 | 0.61 | — | — | |
| SCHEMBL160834 | 0.59 | — | — | |
| SCHEMBL5533908 | 0.59 | — | — | |
| Allyl Alcohol SCHEMBL11039211 | 0.59 | — | — |
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-4034140-A | Heat-curable silicone elastomers having unprimed adhesion | DOW CORNING CORPORATION (US) | 1977-07-05 | — | — | US | disclosed |