⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL39563 | 0.98 | — | — | |
| SCHEMBL379936 | 0.98 | — | — | |
| SCHEMBL4325398 | 0.96 | — | — | |
| SCHEMBL4321193 | 0.96 | — | — | |
| SCHEMBL4321175 | 0.96 | — | — | |
| SCHEMBL3916301 | 0.96 | — | — | |
| SCHEMBL465442 | 0.96 | — | — | |
| Charcoal, Activated SCHEMBL7918760 | 0.96 | — | — | |
| SCHEMBL17472826 | 0.96 | — | — | |
| Methane SCHEMBL28375784 | 0.96 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2203514-B8 | BUTYL RUBBER COMPOUNDS COMPRISING A THREE COMPONENT MIXED MODIFIER SYSTEM | LANXESS INT SA (CH) | 2012-12-12 | — | — | EP | claimed |
| EP-2203514-B1 | BUTYL RUBBER COMPOUNDS COMPRISING A THREE COMPONENT MIXED MODIFIER SYSTEM | LANXESS INC (CA) | 2012-09-05 | — | — | EP | claimed |
| EP-2455422-A1 | Butyl rubber compounds comprising a mixed modifier system | Lanxess Inc. (CA) | 2012-05-23 | — | — | EP | claimed |
| US-20110184087-A1 | BUTYL RUBBER COMPOUNDS COMPRISING A MIXED MODIFIER SYSTEM | LANXESS INC. (CA) | 2011-07-28 | — | — | US | claimed |
| JP-2011500899-A | — | — | 2011-01-06 | — | — | JP | claimed |
| US-20100298476-A1 | BUTYL RUBBER COMPOUNDS COMPRISING A THREE COMPONENT MIXED MODIFIER SYSTEM | LANXESS INC. (CA) | 2010-11-25 | — | — | US | claimed |
| EP-2203514-A1 | BUTYL RUBBER COMPOUNDS COMPRISING A THREE COMPONENT MIXED MODIFIER SYSTEM | LANXESS Inc. (CA) | 2010-07-07 | — | — | EP | claimed |
| WO-2009049413-A1 | BUTYL RUBBER COMPOUNDS COMPRISING A THREE COMPONENT MIXED MODIFIER SYSTEM | LANXESS INC. (CA) | 2009-04-23 | — | — | WO | claimed |