⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4853869 | 0.75 | CDC25A (0.32) | — | |
| SCHEMBL31296681 | 0.74 | — | — | |
| SCHEMBL17273342 | 0.74 | — | — | |
| SCHEMBL30831900 | 0.74 | — | — | |
| SCHEMBL29413672 | 0.69 | MAP3K9 (0.33) | — | |
| SCHEMBL2490555 | 0.69 | MAP3K9 (0.33) | — | |
| SCHEMBL4853859 | 0.67 | GPR3 (0.31) | — | |
| SCHEMBL349140 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL16415808 | 0.62 | — | — | |
| SCHEMBL2181813 | 0.61 | POLB (0.31) | — |
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-7470290-B2 | Hydroscopic polymer gels for easier cleaning | THE CLOROX COMPANY (US) | 2008-12-30 | — | — | US | disclosed |
| US-7183010-B2 | Organic light-emitting diode devices with improved operational stability | EASTMAN KODAK CORPORATION (US) | 2007-02-27 | — | — | US | disclosed |
| US-20050245428-A1 | Hydroscopic polymer gels for easier cleaning | RODRIGUES KLIN A | 2005-11-03 | — | — | US | disclosed |
| US-20040076853-A1 | Organic light-emitting diode devices with improved operational stability | EASTMAN KODAK COMPANY | 2004-04-22 | — | — | US | disclosed |