⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2052242 | 0.67 | — | — | |
| SCHEMBL7068166 | 0.64 | — | — | |
| SCHEMBL708811 | 0.62 | — | — | |
| SCHEMBL1900616 | 0.61 | — | — | |
| SCHEMBL1902723 | 0.61 | — | — | |
| SCHEMBL29064650 | 0.59 | — | — | |
| SCHEMBL11879358 | 0.56 | — | — | |
| SCHEMBL82966 | 0.56 | — | — | |
| SCHEMBL27784789 | 0.56 | — | — | |
| SCHEMBL2466534 | 0.53 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8008370-B2 | Coating containing blocked isocyanates; wear resistant protective coatings; clear coating; mixture of polyurethane with metal or silicocn oxides | WACKER CHEMIE AG (DE) | 2011-08-30 | — | — | US | disclosed |
| US-20090148778-A1 | ANODE, METHOD OF MANUFACTURING IT, AND BATTERY | SONY CORPORATION (JP) | 2009-06-11 | — | — | US | disclosed |
| US-5256749-A | Acrylic ester or amide polymers; for optical waveguides, Langmuir-Blodgett process, optical filters | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-10-26 | — | — | US | disclosed |