⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL906287 | 1.00 | — | — | |
| SCHEMBL6055656 | 0.99 | — | — | |
| Hydrochloric Acid SCHEMBL7640397 | 0.83 | — | — | |
| SCHEMBL728340 | 0.83 | — | — | |
| SCHEMBL7944936 | 0.76 | — | — | |
| SCHEMBL5968791 | 0.72 | — | — | |
| SCHEMBL5968790 | 0.72 | — | — | |
| SCHEMBL5975327 | 0.72 | MAOB (0.33) | — | |
| SCHEMBL5974947 | 0.70 | MTNR1A (0.34) | — | |
| SCHEMBL7218531 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-1999000431-A1 | PROCESS FOR THE POLYMERISATION OF OLEFINS IN THE GAS PHASE | BP CHEMICALS LIMITED (GB) | 1999-01-07 | — | — | WO | disclosed |