⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7028244 | 0.83 | CHRNB2 (0.33) | — | |
| SCHEMBL7026733 | 0.83 | CHRNB2 (0.33) | — | |
| SCHEMBL7542813 | 0.81 | — | — | |
| SCHEMBL5597350 | 0.80 | — | — | |
| Biphenyl SCHEMBL819335 | 0.73 | ALDH1A1 (0.39) | — | |
| SCHEMBL6559823 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL6286843 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL6285341 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL5695989 | 0.69 | PTGS2 (0.32) | — | |
| Benzene SCHEMBL28489637 | 0.67 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1062257-A1 | ETHYLENE COPOLYMERS WITH NARROW COMPOSITION DISTRIBUTION AND HIGH MELTING TEMPERATURES, AND METHODS OF PRODUCTION THEREOF | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2000-12-27 | — | — | EP | disclosed |
| WO-2000040625-A1 | ETHYLENE COPOLYMERS WITH NARROW COMPOSITION DISTRIBUTION AND HIGH MELTING TEMPERATURES, AND METHODS OF PRODUCTION THEREOF | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2000-07-13 | — | — | WO | disclosed |