⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL126250 | 0.74 | — | — | |
| SCHEMBL13303955 | 0.74 | — | — | |
| Ethylene SCHEMBL21825578 | 0.70 | — | — | |
| SCHEMBL25630371 | 0.68 | — | — | |
| SCHEMBL5090103 | 0.67 | CA1 (0.31) | — | |
| SCHEMBL7517263 | 0.67 | — | — | |
| SCHEMBL8468962 | 0.67 | — | — | |
| SCHEMBL7158553 | 0.67 | CA1 (0.31) | — | |
| SCHEMBL15683 | 0.61 | — | — | |
| SCHEMBL31554776 | 0.60 | — | — |
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-20060148980-A1 | Waterborne self-crosslinkable polyurethane dispersions and polyurethane:acrylic hybrid dispersions | CYTEC SURFACE SPECIALTIES, S.A. (BE) | 2006-07-06 | — | — | US | disclosed |
| EP-1646669-A1 | WATERBORNE SELF-CROSSLINKABLE POLYURETHANE DISPERSIONS AND POLYURETHANE: ACRYLIC HYBRID DISPERSIONS | CYTEC SURFACE SPECIALTIES, S.A. (BE) | 2006-04-19 | — | — | EP | disclosed |
| WO-2005005504-A1 | WATERBONE SELF-CROSSLINKABLE POLYURETHANE DISPERSIONS AND POLYURETHANE: ACRYLIC HYBRID DISPERSIONS | CYTEC SURFACE SPECIALTIES, S.A. (BE) | 2005-01-20 | — | — | WO | disclosed |