⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6284229 | 0.84 | — | — | |
| SCHEMBL16349255 | 0.80 | GAA (0.37) | — | |
| SCHEMBL20557022 | 0.77 | POLA1 (0.36) | — | |
| SCHEMBL4802283 | 0.75 | — | — | |
| SCHEMBL7601034 | 0.70 | — | — | |
| Tempol SCHEMBL23234 | 0.69 | GAA (0.37) | — | |
| SCHEMBL4386889 | 0.68 | — | — | |
| SCHEMBL6827362 | 0.68 | — | — | |
| SCHEMBL4801717 | 0.67 | — | — | |
| SCHEMBL7935111 | 0.67 | GAA (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1192197-B1 | METHOD FOR PRODUCING GRAFT COPOLYMERS, CONTAINING AN ELASTIC GRAFT COPOLYMER BACKBONE | BASF AG (DE) | 2002-12-04 | — | — | EP | disclosed |