⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6460439 | 0.96 | — | — | |
| SCHEMBL6453499 | 0.93 | — | — | |
| SCHEMBL6457048 | 0.90 | — | — | |
| SCHEMBL3677359 | 0.76 | NFKB1 (0.30) | — | |
| SCHEMBL6461774 | 0.73 | — | — | |
| SCHEMBL4600169 | 0.72 | — | — | |
| SCHEMBL3619462 | 0.68 | — | — | |
| SCHEMBL28240185 | 0.67 | — | — | |
| SCHEMBL4629519 | 0.66 | — | — | |
| SCHEMBL6260418 | 0.65 | — | — |
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-1049704-B1 | BRIDGED METALLOCENES, PREPARATION, USE IN CATALYTIC SYSTEMS | BASELL POLYOLEFINE GMBH (DE) | 2005-07-27 | — | — | EP | disclosed |
| EP-1049704-A1 | BRIDGED METALLOCENES, PREPARATION, USE IN CATALYTIC SYSTEMS | Montell Technology Company bv (NL) | 2000-11-08 | — | — | EP | disclosed |
| WO-2000031088-A1 | BRIDGED METALLOCENES, PREPARATION, USE IN CATALYTIC SYSTEMS | MONTELL TECHNOLOGY COMPANY BV (NL) | 2000-06-02 | — | — | WO | disclosed |