⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28831735 | 0.94 | — | — | |
| SCHEMBL14118745 | 0.91 | — | — | |
| SCHEMBL54555 | 0.89 | — | — | |
| SCHEMBL8339193 | 0.87 | — | — | |
| SCHEMBL28776035 | 0.87 | — | — | |
| SCHEMBL5462873 | 0.85 | — | — | |
| SCHEMBL28253208 | 0.85 | — | — | |
| SCHEMBL4576082 | 0.84 | — | — | |
| SCHEMBL1123449 | 0.84 | — | — | |
| SCHEMBL14118771 | 0.84 | — | — |
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-1350823-B1 | Water based intercoat coating composition and multi-layer coating film-forming method by use of the same | KANSAI PAINT CO LTD (JP) | 2007-08-22 | — | — | EP | disclosed |
| US-4554336-A | TRIFUNCTIONAL ACRYLATE | SYBRON CORPORATION (US) | 1985-11-19 | — | — | US | disclosed |