⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2557764 | 0.71 | — | — | |
| SCHEMBL83051 | 0.71 | — | — | |
| SCHEMBL2702532 | 0.71 | — | — | |
| SCHEMBL22346065 | 0.70 | MMP8 (0.31) | — | |
| SCHEMBL4460288 | 0.68 | — | — | |
| SCHEMBL675999 | 0.68 | — | — | |
| SCHEMBL27816453 | 0.67 | — | — | |
| SCHEMBL4816208 | 0.67 | OPRM1 (0.32) | — | |
| SCHEMBL1938060 | 0.67 | — | — | |
| SCHEMBL5424792 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2421874-A1 | COMPOSITION CONTAINING QUATERNARY AMINO-FUNCTIONAL ORGANOSILICON COMPOUNDS AND PRODUCTION AND USE THEREOF | Evonik Degussa GmbH (DE) | 2012-02-29 | — | — | EP | claimed |
| WO-2010121873-A1 | COMPOSITION CONTAINING QUATERNARY AMINO-FUNCTIONAL ORGANOSILICON COMPOUNDS AND PRODUCTION AND USE THEREOF | EVONIK DEGUSSA GMBH (DE) | 2010-10-28 | — | — | WO | claimed |
| CN-114341206-A | Conjugated diene polymer, method for producing conjugated diene polymer, conjugated diene polymer composition, and rubber composition | 旭化成株式会社 | 2022-04-12 | — | — | CN | disclosed |
| EP-0135813-B1 | PREPARATION OF AMINOPROPYLTRIALKOXYSILANES AND/OR AMINOALKYLALOXYSILANES | UNION CARBIDE CORPORATION (US) | 1988-09-07 | — | — | EP | disclosed |