⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19713197 | 0.69 | — | — | |
| SCHEMBL35058 | 0.67 | — | — | |
| SCHEMBL6692296 | 0.64 | — | — | |
| SCHEMBL1268918 | 0.64 | — | — | |
| SCHEMBL2108652 | 0.64 | — | — | |
| SCHEMBL701646 | 0.64 | — | — | |
| SCHEMBL1361040 | 0.61 | — | — | |
| SCHEMBL2671652 | 0.61 | — | — | |
| Lithium Ion SCHEMBL6692293 | 0.61 | — | — | |
| SCHEMBL1360397 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0504661-B1 | Ziegler catalyst system | BASF AG (DE) | 1996-02-07 | — | — | EP | disclosed |
| EP-0504661-A1 | Ziegler catalyst system | BASF Aktiengesellschaft (DE) | 1992-09-23 | — | — | EP | disclosed |
| EP-0497102-A2 | Vanadium and magnesium containing component for a Ziegler-Natta catalytic system | BASF Aktiengesellschaft (DE) | 1992-08-05 | — | — | EP | disclosed |