⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11680447 | 0.73 | — | — | |
| SCHEMBL19201521 | 0.73 | — | — | |
| SCHEMBL24114271 | 0.71 | L3MBTL1 (0.30) | — | |
| SCHEMBL7037854 | 0.69 | CA4 (0.38) | — | |
| Thiourea SCHEMBL27489660 | 0.67 | CA4 (0.31) | — | |
| SCHEMBL8295691 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL18526347 | 0.65 | ALDH1A1 (0.35) | — | |
| SCHEMBL21298703 | 0.65 | CYP2C19 (0.33) | — | |
| SCHEMBL11343993 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL7449805 | 0.65 | ALDH1A1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3526211-B1 | FLAME RETARDANTS | BRUAG FIRE PROT AG (CH) | 2023-02-22 | — | — | EP | disclosed |
| WO-2018069249-A1 | FLAME RETARDANTS | BRUAG FIRE PROTECTION AG (CH) | 2018-04-19 | — | — | WO | disclosed |