⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL812358 | 0.88 | KDM1A (0.31) | — | |
| SCHEMBL216534 | 0.84 | — | — | |
| SCHEMBL4082379 | 0.82 | — | — | |
| SCHEMBL8382207 | 0.77 | — | — | |
| SCHEMBL217532 | 0.77 | — | — | |
| SCHEMBL442146 | 0.75 | — | — | |
| SCHEMBL5951649 | 0.74 | EDNRB (0.31) | — | |
| SCHEMBL8673404 | 0.74 | P2RX7 (0.35) | — | |
| SCHEMBL5952488 | 0.73 | GSTP1 (0.31) | — | |
| SCHEMBL813415 | 0.73 | BCL2 (0.34) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1740626-A1 | CATALYST SYSTEM FOR OLEFIN POLYMERIZATION, ITS PRODUCTION AND USE | Basell Polyolefine GmbH (DE) | 2007-01-10 | — | — | EP | disclosed |
| WO-2005103099-A1 | CATALYST SYSTEM FOR OLEFIN POLYMERIZATION, ITS PRODUCTION AND USE | BASELL POLYOLEFINE GMBH (DE) | 2005-11-03 | — | — | WO | disclosed |