⚠ 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 | |
|---|---|---|---|---|
| Butadiene SCHEMBL5418231 | 0.77 | — | — | |
| SCHEMBL9766049 | 0.74 | — | — | |
| SCHEMBL5279 | 0.74 | — | — | |
| Formaldehyde SCHEMBL28807537 | 0.72 | — | — | |
| SCHEMBL18664568 | 0.71 | — | — | |
| SCHEMBL4949315 | 0.71 | — | — | |
| SCHEMBL7933983 | 0.71 | — | — | |
| Cyclopentane SCHEMBL9453154 | 0.71 | — | — | |
| SCHEMBL12802725 | 0.71 | — | — | |
| SCHEMBL11372758 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7173091-B2 | Polymer blend | IONPHASE OY (FI) | 2007-02-06 | — | — | US | disclosed |
| EP-1406968-B1 | POLYMER BLEND | IONPHASE OY (FI) | 2005-09-21 | — | — | EP | disclosed |
| US-20040171752-A1 | Polymer blend | IONPHASE OY (FI) | 2004-09-02 | — | — | US | disclosed |