⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11630112 | 0.84 | — | — | |
| SCHEMBL13410836 | 0.78 | — | — | |
| SCHEMBL11047539 | 0.75 | — | — | |
| SCHEMBL16903699 | 0.75 | — | — | |
| SCHEMBL22421694 | 0.74 | — | — | |
| SCHEMBL823008 | 0.70 | CYP1A2 (0.31) | — | |
| SCHEMBL13466732 | 0.70 | MEN1 (0.30) | — | |
| SCHEMBL17860889 | 0.67 | — | — | |
| SCHEMBL11043096 | 0.67 | — | — | |
| SCHEMBL22115892 | 0.67 | — | — |
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-10000625-B2 | Flame retarding agent, flame-retardant aqueous resin composition and flame-retardant urethane resin composition containing said flame-retarding agent, and use therefor | DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) | 2018-06-19 | — | — | US | disclosed |
| US-9988510-B2 | Flame retardant and flame retardant polyurethane resin composition | DAIHACHI CHEMICAL INDUSTRY CO., LTD. (JP) | 2018-06-05 | — | — | US | disclosed |