⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14444425 | 0.68 | HTT (0.34) | — | |
| SCHEMBL11491477 | 0.67 | GAA (0.41) | — | |
| SCHEMBL31616955 | 0.67 | ALDH1A1 (0.38) | — | |
| SCHEMBL11474581 | 0.66 | JAK1 (0.31) | — | |
| SCHEMBL21206848 | 0.63 | — | — | |
| SCHEMBL21164614 | 0.63 | DPP4 (0.33) | — | |
| SCHEMBL21782065 | 0.61 | ALDH1A1 (0.38) | — | |
| SCHEMBL15014481 | 0.61 | ALDH1A1 (0.38) | — | |
| SCHEMBL1190555 | 0.61 | — | — | |
| SCHEMBL5831087 | 0.61 | JAK1 (0.39) | — |
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-3853277-A1 | TWO-COMPONENT COATING COMPOSITION, METHOD FOR COATING A SUBSTRATE, COATED SUBSTRATE, AND USE OF SUCH COATING COMPOSITION FOR IMPROVING EROSION RESISTANCE | Akzo Nobel Coatings International B.V. (NL) | 2021-07-28 | — | — | EP | disclosed |
| WO-2020058301-A1 | TWO-COMPONENT COATING COMPOSITION, METHOD FOR COATING A SUBSTRATE, COATED SUBSTRATE, AND USE OF SUCH COATING COMPOSITION FOR IMPROVING EROSION RESISTANCE | AKZO NOBEL COATINGS INTERNATIONAL B.V. (NL) | 2020-03-26 | — | — | WO | disclosed |