⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6297933 | 0.81 | — | — | |
| SCHEMBL6300269 | 0.77 | — | — | |
| SCHEMBL1979147 | 0.67 | — | — | |
| SCHEMBL3672561 | 0.64 | — | — | |
| SCHEMBL15157474 | 0.62 | — | — | |
| SCHEMBL9559663 | 0.61 | — | — | |
| SCHEMBL6389376 | 0.60 | — | — | |
| SCHEMBL24592967 | 0.56 | — | — | |
| SCHEMBL11554917 | 0.56 | HTT (0.35) | — | |
| SCHEMBL11033492 | 0.55 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1090916-B1 | 4-methylene-1,3-dioxolanes having functional groups | DAINIPPON INK & CHEMICALS (JP) | 2003-09-03 | — | — | EP | disclosed |
| US-6388104-B1 | ODORLESS CROSSLINKING | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2002-05-14 | — | — | US | disclosed |
| EP-1090916-A1 | 4-methylene-1,3-dioxolanes having functional groups | DAINIPPON INK AND CHEMICALS, INC. (JP) | 2001-04-11 | — | — | EP | disclosed |