⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21227230 | 0.76 | SIGMAR1 (0.39) | — | |
| SCHEMBL22692581 | 0.73 | — | — | |
| SCHEMBL16473999 | 0.71 | GRIN2D (0.31) | — | |
| SCHEMBL23982944 | 0.71 | GRIN2D (0.31) | — | |
| SCHEMBL17372715 | 0.70 | GRIN2D (0.32) | — | |
| SCHEMBL6876243 | 0.70 | GRIN2D (0.31) | — | |
| SCHEMBL12087445 | 0.68 | GAA (0.36) | — | |
| SCHEMBL12740474 | 0.68 | POLB (0.43) | — | |
| SCHEMBL25642562 | 0.65 | IDO1 (0.41) | — | |
| SCHEMBL22109791 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20150322092-A1 | Boron-Containing Diacylhydrazines | INTREXON CORPORATION (US) | 2015-11-12 | — | — | US | disclosed |
| US-20150322092-A1 | Boron-Containing Diacylhydrazines | INTREXON CORPORATION (US) | 2015-11-12 | — | — | US | disclosed |