⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL483057 | 0.91 | RIPK1 (0.37) | — | |
| SCHEMBL268503 | 0.89 | — | — | |
| SCHEMBL483156 | 0.87 | ADORA2A (0.32) | — | |
| SCHEMBL483042 | 0.86 | POLB (0.40) | — | |
| SCHEMBL482898 | 0.86 | — | — | |
| SCHEMBL483253 | 0.85 | — | — | |
| SCHEMBL599903 | 0.84 | MLYCD (0.34) | — | |
| SCHEMBL483360 | 0.83 | MEN1 (0.36) | — | |
| SCHEMBL482924 | 0.81 | RIPK1 (0.35) | — | |
| SCHEMBL483195 | 0.81 | RIPK1 (0.31) | — |
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-5026625-A | Photoinitiators for polymerization of ethylenically unsaturated compounds | CIBA-GEIGY CORPORATION (US) | 1991-06-25 | — | — | US | disclosed |