⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL437746 | 0.86 | FNTA (0.35) | — | |
| SCHEMBL108253 | 0.86 | FNTA (0.35) | — | |
| SCHEMBL108251 | 0.86 | FNTA (0.35) | — | |
| SCHEMBL1903505 | 0.84 | FNTA (0.34) | — | |
| SCHEMBL1900885 | 0.84 | FNTA (0.34) | — | |
| SCHEMBL1900886 | 0.82 | — | — | |
| SCHEMBL1900446 | 0.82 | — | — | |
| SCHEMBL4453251 | 0.76 | TSHR (0.33) | — | |
| Maleic Acid SCHEMBL2231406 | 0.76 | HCAR2 (0.30) | — | |
| SCHEMBL26616670 | 0.75 | ACHE (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0044891-B1 | PAINTABLE AND VULCANIZABLE SILICONE RUBBER, PROCESS FOR ITS MANUFACTURE AND PAINTED LAMINATE STRUCTURE | GENERAL ELECTRIC COMPANY (US) | 1985-06-05 | — | — | EP | disclosed |