⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL584362 | 0.90 | — | — | |
| SCHEMBL6114549 | 0.79 | CYP3A4 (0.31) | — | |
| SCHEMBL19872816 | 0.75 | MEN1 (0.35) | — | |
| SCHEMBL28536898 | 0.74 | CYP3A4 (0.36) | — | |
| SCHEMBL28539145 | 0.74 | CYP3A4 (0.36) | — | |
| SCHEMBL13286768 | 0.72 | ADORA2B (0.36) | — | |
| SCHEMBL2026591 | 0.71 | TYMP (0.38) | — | |
| SCHEMBL5070117 | 0.71 | TP53 (0.32) | — | |
| SCHEMBL11438514 | 0.70 | SMN1; SMN2 (0.42) | — | |
| SCHEMBL22711592 | 0.69 | — | — |
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-3126409-A1 | CROSSLINKABLE POLYMERIC COMPOSITIONS WITH DIALLYL ISOCYANURATE CROSSLINKING COAGENTS, METHODS FOR MAKING THE SAME, AND ARTICLES MADE THEREFROM | Dow Global Technologies Llc (US) | 2017-02-08 | — | — | EP | disclosed |
| WO-2015149632-A1 | CROSSLINKABLE POLYMERIC COMPOSITIONS WITH DIALLYL ISOCYANURATE CROSSLINKING COAGENTS, METHODS FOR MAKING THE SAME, AND ARTICLES MADE THEREFROM | DOW GLOBAL TECHNOLOGIES LLC (US) | 2015-10-08 | — | — | WO | disclosed |