⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5182031 | 0.96 | MGAM (0.53) | — | |
| SCHEMBL584049 | 0.96 | — | — | |
| SCHEMBL22325638 | 0.96 | — | — | |
| SCHEMBL14126244 | 0.96 | MGAM (0.53) | — | |
| SCHEMBL166518 | 0.96 | — | — | |
| SCHEMBL1062079 | 0.96 | MGAM (0.53) | — | |
| SCHEMBL9165952 | 0.92 | MGAM (0.50) | — | |
| Hydrochloric Acid SCHEMBL28296804 | 0.92 | — | — | |
| SCHEMBL28256028 | 0.92 | — | — | |
| Phosphine SCHEMBL27597761 | 0.92 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-102864001-A | Energy-saving environment-friendly process for producing coal burning accelerant | TONGLING LVYUAN COMPOSITES CO LTD | 2013-01-09 | — | — | CN | disclosed |