⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9016932 | 0.77 | KDM4E (0.31) | — | |
| SCHEMBL218727 | 0.69 | KDM4E (0.30) | — | |
| SCHEMBL5616594 | 0.65 | KDM4E (0.30) | — | |
| SCHEMBL7940884 | 0.62 | CA12 (0.32) | — | |
| SCHEMBL8514694 | 0.62 | EED (0.31) | — | |
| SCHEMBL27554984 | 0.60 | — | — | |
| SCHEMBL8845717 | 0.60 | — | — | |
| SCHEMBL27554985 | 0.60 | — | — | |
| SCHEMBL8168858 | 0.60 | — | — | |
| SCHEMBL5616490 | 0.60 | ESR1 (0.40) | — |
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-2186832-B1 | Process for the preparation of an unsupported, solid metallocene catalyst system and its use in polymerization of olefins | BOREALIS AG (AT) | 2012-09-12 | — | — | EP | disclosed |
| EP-2186832-A1 | Process for the preparation of an unsupported, solid metallocene catalyst system and its use in polymerization of olefins | Borealis AG (AT) | 2010-05-19 | — | — | EP | disclosed |
| WO-2010052239-A1 | PROCESS FOR THE PREPARATION OF AN UNSUPPORTED, SOLID METALLOCENE CATALYST SYSTEM AND ITS USE IN POLYMERIZATION OF OLEFINS | BOREALIS AG (AT) | 2010-05-14 | — | — | WO | disclosed |