⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27466097 | 0.98 | — | — | |
| SCHEMBL483529 | 0.76 | FDPS (0.35) | — | |
| SCHEMBL897711 | 0.74 | GGPS1 (0.39) | — | |
| SCHEMBL633195 | 0.74 | GGPS1 (0.39) | — | |
| SCHEMBL1577625 | 0.74 | GGPS1 (0.39) | — | |
| SCHEMBL27959 | 0.74 | GGPS1 (0.39) | — | |
| SCHEMBL875740 | 0.74 | GGPS1 (0.39) | — | |
| SCHEMBL4235171 | 0.74 | GGPS1 (0.39) | — | |
| SCHEMBL5478038 | 0.73 | FDPS (0.32) | — | |
| SCHEMBL2111061 | 0.73 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7576143-B2 | curable addition-condensation copolymers comprising polyurethane acrylates, used as coatings having wear resistance, hardness and flexibility | BASF AKTIENGESELLSCHAFT (DE) | 2009-08-18 | — | — | US | disclosed |
| US-20080194725-A1 | Radiation-Hardenable Compounds | BASF AKTIENGESELLSCHAFT (DE) | 2008-08-14 | — | — | US | disclosed |
| CN-100406486-C | Fluorochemical urethane composition for treatment of fibrous substrates | 3M INNOVATIVE PROPERTIES CO (US) | 2008-07-30 | — | — | CN | disclosed |
| CN-1610710-A | Fluorochemical urethane composition for treatment of fibrous substrates | 3M INNOVATIVE PROPERTIES CO (US) | 2005-04-27 | — | — | CN | disclosed |