⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9297374 | 0.79 | — | — | |
| SCHEMBL412042 | 0.73 | — | — | |
| SCHEMBL15533526 | 0.73 | — | — | |
| SCHEMBL11434784 | 0.73 | — | — | |
| SCHEMBL9299372 | 0.72 | TRPA1 (0.34) | — | |
| SCHEMBL9134075 | 0.71 | — | — | |
| SCHEMBL27414895 | 0.71 | — | — | |
| SCHEMBL27656765 | 0.71 | — | — | |
| SCHEMBL2143543 | 0.71 | — | — | |
| SCHEMBL6914383 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2588486-B1 | SUPPORTED LIGANDS HAVING A HIGH LOCAL DENSITY OF COORDINATING ATOMS | CENTRE NAT RECH SCIENT (FR) | 2017-05-31 | — | — | EP | claimed |
| US-20130158219-A1 | SUPPORTED LIGANDS HAVING A HIGH LOCAL DENSITY OF COORDINATING ATOMS | UNIVERSITE DE BOURGOGNE (FR) | 2013-06-20 | — | — | US | claimed |
| EP-2588486-B1 | SUPPORTED LIGANDS HAVING A HIGH LOCAL DENSITY OF COORDINATING ATOMS | CENTRE NAT RECH SCIENT (FR) | 2017-05-31 | — | — | EP | disclosed |
| US-9045511-B2 | Supported ligands having a high local density of coordinating atoms | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2015-06-02 | — | — | US | disclosed |
| US-20130158219-A1 | SUPPORTED LIGANDS HAVING A HIGH LOCAL DENSITY OF COORDINATING ATOMS | UNIVERSITE DE BOURGOGNE (FR) | 2013-06-20 | — | — | US | disclosed |