⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL147275 | 0.78 | — | — | |
| SCHEMBL9456939 | 0.67 | ALDH1A1 (0.38) | — | |
| SCHEMBL5248670 | 0.62 | — | — | |
| SCHEMBL5790040 | 0.62 | — | — | |
| SCHEMBL979900 | 0.62 | NOTUM (0.32) | — | |
| SCHEMBL6057523 | 0.62 | TSHR (0.32) | — | |
| SCHEMBL49949 | 0.62 | TYR (0.46) | — | |
| SCHEMBL27051 | 0.61 | — | — | |
| SCHEMBL40632 | 0.61 | — | — | |
| SCHEMBL25407 | 0.61 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1325939-B1 | Process for preparing co-gels having polyazacycloalkane moieties and their use | AIR LIQUIDE (FR) | 2006-06-14 | — | — | EP | claimed |
| EP-1051422-B1 | SILICA GEL INCORPORATING POLYAZACYCLOALKANE STRUCTURAL UNITS | AIR LIQUIDE (FR) | 2003-07-02 | — | — | EP | claimed |
| US-6524372-B1 | Separation and purification of gases; 1,4,8,11-Tetrakis(3-(triethoxysilyl)propyl)-1,4,8,11 -tetraazacyclotetradecane | L′Air Liquide, Societe Anonyme a Directoire et Conseil de Surveillance pour l′Etude et l′Exploitation des Procedes Georges Claude (FR) | 2003-02-25 | — | — | US | claimed |
| CN-114615999-A | Drug antibody conjugates | 法马马有限公司 | 2022-06-10 | — | — | CN | disclosed |
| CN-113166102-A | Anticancer compounds | 法马马有限公司 | 2021-07-23 | — | — | CN | disclosed |
| US-6524372-B1 | Separation and purification of gases; 1,4,8,11-Tetrakis(3-(triethoxysilyl)propyl)-1,4,8,11 -tetraazacyclotetradecane | L′Air Liquide, Societe Anonyme a Directoire et Conseil de Surveillance pour l′Etude et l′Exploitation des Procedes Georges Claude (FR) | 2003-02-25 | — | — | US | disclosed |