⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10874454 | 0.86 | — | — | |
| SCHEMBL5968501 | 0.68 | — | — | |
| SCHEMBL1907184 | 0.67 | CYP3A4 (0.36) | — | |
| SCHEMBL7176093 | 0.62 | — | — | |
| SCHEMBL3133217 | 0.61 | CYP3A4 (0.33) | — | |
| SCHEMBL9810776 | 0.61 | — | — | |
| SCHEMBL995308 | 0.60 | CYP3A4 (0.36) | — | |
| SCHEMBL7196759 | 0.60 | — | — | |
| SCHEMBL19560044 | 0.58 | — | — | |
| SCHEMBL4146029 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20080041273-A1 | Scratchproof, Radiation-Curable Coatings | BASF COATINGS AKTIENGESELLSCHAFT (DE) | 2008-02-21 | — | — | US | disclosed |