⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL141878 | 0.97 | — | — | |
| SCHEMBL28901134 | 0.94 | — | — | |
| SCHEMBL5675458 | 0.75 | — | — | |
| Acetone SCHEMBL28129807 | 0.75 | LMNA (0.38) | — | |
| SCHEMBL2858726 | 0.75 | — | — | |
| SCHEMBL534789 | 0.73 | — | — | |
| SCHEMBL14197388 | 0.73 | — | — | |
| SCHEMBL27460677 | 0.73 | GAA (0.44) | — | |
| SCHEMBL27926678 | 0.71 | — | — | |
| SCHEMBL13434035 | 0.71 | GAA (0.42) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109251466-A | Fire-resistant engineering plastics and preparation method thereof | 东华大学 | 2019-01-22 | — | — | CN | disclosed |
| CN-109208114-A | Flame-proof antibiotic PET fiber and its slice electrospinning method for preparing | 东华大学 | 2019-01-15 | — | — | CN | disclosed |
| CN-109181056-A | Antibacterial fresh-keeping film and preparation method thereof | 东华大学 | 2019-01-11 | — | — | CN | disclosed |
| CN-109096502-A | Flame-proof antibiotic master batch and preparation method thereof | 东华大学 | 2018-12-28 | — | — | CN | disclosed |