⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25330644 | 0.78 | — | — | |
| SCHEMBL25330996 | 0.78 | — | — | |
| SCHEMBL3510173 | 0.78 | — | — | |
| SCHEMBL16404825 | 0.74 | — | — | |
| SCHEMBL22251697 | 0.74 | — | — | |
| SCHEMBL12327842 | 0.72 | — | — | |
| SCHEMBL19409927 | 0.69 | ALDH1A1 (0.48) | — | |
| SCHEMBL16731347 | 0.69 | — | — | |
| SCHEMBL22109773 | 0.68 | — | — | |
| SCHEMBL10552644 | 0.68 | ALDH1A1 (0.52) | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2358803-B1 | CONTAINER AND COMPOSITION WITH DIESTER GAS BARRIER ENHANCING COMPOUNDS | COCA COLA CO (US) | 2021-06-30 | — | — | EP | disclosed |
| EP-2358804-B1 | PET CONTAINER AND COMPOSITIONS HAVING ENHANCED MECHANICAL PROPERTIES AND GAS BARRIER PROPERTIES | COCA COLA CO (US) | 2020-02-05 | — | — | EP | disclosed |
| US-9464184-B2 | Container and composition for enhanced gas barrier properties | THE COCA-COLA COMPANY (US) | 2016-10-11 | — | — | US | disclosed |
| US-9359488-B2 | Pet container and compositions having enhanced mechanical properties and gas barrier properties and methods | THE COCA-COLA COMPANY (US) | 2016-06-07 | — | — | US | disclosed |
| US-20150232641-A1 | CONTAINER AND COMPOSITION FOR ENHANCED GAS BARRIER PROPERTIES | THE COCA-COLA COMPANY (US) | 2015-08-20 | — | — | US | disclosed |
| US-9051116-B2 | Container and composition for enhanced gas barrier properties | THE COCA-COLA COMPANY (US) | 2015-06-09 | — | — | US | disclosed |
| US-20150045482-A1 | Pet Container and Compositions Having Enhanced Mechanical Properties and Gas Barrier Properties and Methods | COCA COLA CO (US) | 2015-02-12 | — | — | US | disclosed |
| US-20140212611-A1 | CONTAINER AND COMPOSITION FOR ENHANCED GAS BARRIER PROPERTIES | THE COCA-COLA COMPANY (US) | 2014-07-31 | — | — | US | disclosed |
| US-20140154446-A1 | Pet Container and Compositions Having Enhanced Mechanical Properties and Gas Barrier Properties | THE COCA-COLA COMPANY (US) | 2014-06-05 | — | — | US | disclosed |
| US-20120121837-A1 | Pet Container and Compositions Having Enhanced Mechanical Properties and Gas Barrier Properties | THE COCA-COLA COMPANY (US) | 2012-05-17 | — | — | US | disclosed |
| EP-2358803-A1 | CONTAINER AND COMPOSITION WITH DIESTER GAS BARRIER ENHANCING COMPOUNDS | The Coca-Cola Company (US) | 2011-08-24 | — | — | EP | disclosed |
| EP-2358804-A1 | PET CONTAINER AND COMPOSITIONS HAVING ENHANCED MECHANICAL PROPERTIES AND GAS BARRIER PROPERTIES | The Coca-Cola Company (US) | 2011-08-24 | — | — | EP | disclosed |
| WO-2010077647-A1 | PET CONTAINER AND COMPOSITIONS HAVING ENHANCED MECHANICAL PROPERTIES AND GAS BARRIER PROPERTIES | THE COCA-COLA COMPANY (US) | 2010-07-08 | — | — | WO | disclosed |
| WO-2010068606-A1 | CONTAINER AND COMPOSITION WITH DIESTER GAS BARRIER ENHANCING COMPOUNDS | THE COCA-COLA COMPANY (US) | 2010-06-17 | — | — | WO | disclosed |
| US-20100143546-A1 | CONTAINER AND COMPOSITION FOR ENHANCED GAS BARRIER PROPERTIES | THE COCA-COLA COMPANY (US) | 2010-06-10 | — | — | US | disclosed |