⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14662005 | 0.72 | — | — | |
| SCHEMBL20509043 | 0.72 | — | — | |
| SCHEMBL4830192 | 0.72 | — | — | |
| SCHEMBL13452614 | 0.65 | — | — | |
| SCHEMBL27408179 | 0.65 | — | — | |
| SCHEMBL28163252 | 0.63 | — | — | |
| SCHEMBL31458645 | 0.63 | TSHR (0.32) | — | |
| SCHEMBL20366394 | 0.63 | — | — | |
| SCHEMBL28261798 | 0.62 | — | — | |
| SCHEMBL25207924 | 0.61 | — | — |
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-2004067586-A2 | MIXED BIMETALLIC OLEFIN POLYMERISATION CATALYST | SAFETEC GMBH (DE) | 2004-08-12 | — | — | WO | disclosed |