⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14690137 | 0.77 | ALDH1A1 (0.31) | — | |
| SCHEMBL298107 | 0.72 | — | — | |
| SCHEMBL1929066 | 0.72 | — | — | |
| SCHEMBL195937 | 0.72 | — | — | |
| SCHEMBL20628102 | 0.70 | — | — | |
| SCHEMBL28578170 | 0.70 | — | — | |
| SCHEMBL2009074 | 0.70 | — | — | |
| Acetic Acid SCHEMBL23406879 | 0.68 | TGFBR1 (0.38) | — | |
| SCHEMBL343252 | 0.68 | — | — | |
| SCHEMBL13778555 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2222717-A1 | POLYMER AQUEOUS DISPERSION WITH CORE/SKIN STRUCTURE, METHOD FOR MAKING SAME AND APPLICATION THEREOF IN COATINGS | Cray Valley S.A. (FR) | 2010-09-01 | — | — | EP | claimed |
| WO-2009095569-A1 | POLYMER AQUEOUS DISPERSION WITH CORE/SKIN STRUCTURE, METHOD FOR MAKING SAME AND APPLICATION THEREOF IN COATINGS | CRAY VALLEY SA (FR) | 2009-08-06 | — | — | WO | claimed |