⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16975853 | 0.74 | — | — | |
| SCHEMBL4955883 | 0.70 | DGAT1 (0.39) | — | |
| SCHEMBL23736459 | 0.70 | POLB (0.37) | — | |
| SCHEMBL22044578 | 0.69 | POLB (0.32) | — | |
| SCHEMBL6283475 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL179521 | 0.66 | — | — | |
| SCHEMBL15616264 | 0.66 | L3MBTL1 (0.32) | — | |
| SCHEMBL14507715 | 0.65 | CA12 (0.30) | — | |
| SCHEMBL13715438 | 0.65 | — | — | |
| SCHEMBL26054034 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6841703-B2 | Open chain alkoxyamine compounds and their use as polymerization regulators | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2005-01-11 | — | — | US | claimed |