⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL61844 | 0.78 | — | — | |
| SCHEMBL5068573 | 0.77 | — | — | |
| SCHEMBL190614 | 0.77 | — | — | |
| SCHEMBL19590727 | 0.76 | GABRR1 (0.30) | — | |
| SCHEMBL5547595 | 0.75 | — | — | |
| SCHEMBL28513025 | 0.75 | — | — | |
| SCHEMBL27926531 | 0.73 | — | — | |
| SCHEMBL28068014 | 0.73 | — | — | |
| SCHEMBL28302096 | 0.72 | — | — | |
| SCHEMBL28145807 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103562248-B | Comprise the two-coat barrier system of polyurethane | 太阳化学有限责任公司 | 2016-10-12 | — | — | CN | disclosed |
| CN-103562248-A | A two-coat barrier system comprising polyurethane | SUN CHEMICAL BV | 2014-02-05 | — | — | CN | disclosed |
| US-20100303748-A1 | METHOD FOR LIGHTENING AND/OR COLORING HUMAN KERATIN FIBERS USING A COMPOSITION COMPRISING AN AMINOTRIALKOXY SILANE OR AMINOTRIALKENYLOXY SILANE COMPOUND AND DEVICE | L'OREAL S.A. (FR) | 2010-12-02 | — | — | US | disclosed |