⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7143050 | 0.77 | — | — | |
| SCHEMBL6345230 | 0.75 | — | — | |
| SCHEMBL7143983 | 0.72 | — | — | |
| SCHEMBL6343850 | 0.70 | — | — | |
| SCHEMBL6342734 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL7142851 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL7189674 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL6346682 | 0.67 | — | — | |
| SCHEMBL8422797 | 0.66 | — | — | |
| SCHEMBL13278887 | 0.64 | — | — |
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-1047702-B1 | BIS(TETRAHYYDRO-INDENYL) METALLOCENES AS OLEFIN-POLYMERIZATION- CATALYST | BASELL POLYOLEFINE GMBH (DE) | 2003-01-22 | — | — | EP | disclosed |