⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22651966 | 0.77 | — | — | |
| SCHEMBL15499155 | 0.77 | — | — | |
| SCHEMBL16079415 | 0.76 | — | — | |
| SCHEMBL5932723 | 0.74 | — | — | |
| SCHEMBL27818770 | 0.71 | ADH1B (0.31) | — | |
| SCHEMBL17253117 | 0.70 | AOC3 (0.31) | — | |
| SCHEMBL13983496 | 0.70 | AOC3 (0.31) | — | |
| SCHEMBL28000985 | 0.70 | CHRM1 (0.37) | — | |
| SCHEMBL28000983 | 0.70 | CHRM1 (0.37) | — | |
| Hydrochloric Acid SCHEMBL28783655 | 0.68 | AOC3 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9127024-B2 | Boron-containing diacylhydrazines | INTREXON CORPORATION (US) | 2015-09-08 | — | — | US | disclosed |
| US-20140274954-A1 | Boron-Containing Diacylhydrazines | INTREXON CORPORATION | 2014-09-18 | — | — | US | disclosed |