⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16005037 | 0.83 | OPRM1 (0.40) | — | |
| SCHEMBL16005247 | 0.81 | OPRM1 (0.50) | — | |
| SCHEMBL1047200 | 0.80 | — | — | |
| SCHEMBL18130910 | 0.80 | — | — | |
| SCHEMBL11646209 | 0.80 | — | — | |
| SCHEMBL2633040 | 0.80 | — | — | |
| SCHEMBL9575723 | 0.79 | SPHK1 (0.50) | — | |
| SCHEMBL4540120 | 0.79 | SPHK1 (0.50) | — | |
| SCHEMBL8871150 | 0.79 | SPHK1 (0.50) | — | |
| SCHEMBL9575917 | 0.79 | SPHK1 (0.50) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012064703-A1 | DOPO-DERIVED FLAME RETARDANT AND SYNTHETIC HYDROGARNETS FOR EPOXY RESIN COMPOSITIONS | ALBEMARLE CORPORATION (US) | 2012-05-18 | — | — | WO | disclosed |