⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30175840 | 0.94 | — | — | |
| SCHEMBL2355383 | 0.89 | — | — | |
| SCHEMBL5836582 | 0.73 | — | — | |
| SCHEMBL4409933 | 0.67 | RXRA (0.36) | — | |
| SCHEMBL1452879 | 0.65 | — | — | |
| SCHEMBL29595023 | 0.63 | TSHR (0.32) | — | |
| SCHEMBL29844183 | 0.62 | CYP19A1 (0.32) | — | |
| SCHEMBL4564959 | 0.62 | RARB (0.31) | — | |
| SCHEMBL1454234 | 0.61 | GAA (0.37) | — | |
| SCHEMBL1452916 | 0.61 | TERT (0.35) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7589160-B2 | homopolymerizing butene/1-/ or copolymerizing with ethylene or propylene in presnece of a metallocene catalyst such as dimethyl-bis-(2,5,5,7,7-pentamethyl-1,5,6,7-tetrahydro-s-indacen-1-yl)-silane, an alumoxane or aluminum compound ( triisobutylaluminum) | BASELL POLYOLEFINE GMBH (DE) | 2009-09-15 | — | — | US | disclosed |
| EP-1567565-B1 | PROCESS FOR PREPARING 1-BUTENE POLYMERS | BASELL POLYOLEFINE GMBH (DE) | 2008-01-09 | — | — | EP | disclosed |
| US-20060052553-A1 | Process for preparing 1-butene polymers | BASELL POLYOLEFINE GMBH (DE) | 2006-03-09 | — | — | US | disclosed |
| EP-1567565-A1 | PROCESS FOR PREPARING 1-BUTENE POLYMERS | Basell Polyolefine GmbH (DE) | 2005-08-31 | — | — | EP | disclosed |
| WO-2004050724-A1 | PROCESS FOR PREPARING 1-BUTENE POLYMERS | BASELL POLYOLEFINE GMBH (DE) | 2004-06-17 | — | — | WO | disclosed |