⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL663693 | 0.69 | — | — | |
| SCHEMBL31378327 | 0.67 | TSHR (0.35) | — | |
| SCHEMBL2874853 | 0.65 | — | — | |
| SCHEMBL41401 | 0.64 | — | — | |
| SCHEMBL5409330 | 0.64 | — | — | |
| SCHEMBL435551 | 0.64 | — | — | |
| SCHEMBL8679582 | 0.63 | — | — | |
| SCHEMBL8780717 | 0.62 | — | — | |
| SCHEMBL23495442 | 0.60 | — | — | |
| SCHEMBL8760150 | 0.60 | — | — |
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-5869576-A | GRAFTING A UNSATURATED COMPOUND ONTO A CARBON MONOXIDE-OLEFIN COPOLYMER USING HIGH ENERGY RADIATION; CURING; ADHESIVES AND GLUES FOR WOOD | SHELL OIL COMPANY (US) | 1999-02-09 | — | — | US | disclosed |