⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1886535 | 0.84 | — | — | |
| SCHEMBL4449628 | 0.74 | — | — | |
| SCHEMBL1890529 | 0.72 | — | — | |
| SCHEMBL4453451 | 0.71 | — | — | |
| SCHEMBL708310 | 0.68 | MEN1 (0.50) | — | |
| SCHEMBL29145071 | 0.64 | MEN1 (0.46) | — | |
| SCHEMBL9861298 | 0.64 | MEN1 (0.33) | — | |
| SCHEMBL4417153 | 0.60 | MEN1 (0.70) | — | |
| SCHEMBL10428033 | 0.60 | MEN1 (0.70) | — | |
| SCHEMBL3746961 | 0.60 | — | — |
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-1460057-B1 | PERFLUOROADAMANTYL ACRYLATE COMPOUND AND INTERMEDIATE THEREFOR | IDEMITSU KOSAN CO (JP) | 2006-12-13 | — | — | EP | disclosed |
| US-7084295-B2 | Perfluoroadamantyl acrylate compound and intermediate therefor | IDEMITSU KOSAN CO., LTD. (JP) | 2006-08-01 | — | — | US | disclosed |
| US-20050131247-A1 | Perfluoroadamantly acrylate compound and intermediate therefor | IDEMITDU PETROCHEMICAL CO., LTD (JP) | 2005-06-16 | — | — | US | disclosed |
| EP-1460057-A1 | PERFLUOROADAMANTYL ACRYLATE COMPOUND AND INTERMEDIATE THEREFOR | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2004-09-22 | — | — | EP | disclosed |