⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9325550 | 0.85 | — | — | |
| SCHEMBL6447946 | 0.81 | — | — | |
| SCHEMBL6447358 | 0.62 | — | — | |
| SCHEMBL8421034 | 0.61 | MAPK1 (0.47) | — | |
| SCHEMBL8421032 | 0.61 | MAPK1 (0.47) | — | |
| SCHEMBL8421030 | 0.61 | MAPK1 (0.47) | — | |
| SCHEMBL6440325 | 0.60 | — | — | |
| SCHEMBL6443015 | 0.60 | — | — | |
| SCHEMBL7095116 | 0.59 | — | — | |
| SCHEMBL6443019 | 0.58 | PDK1 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3533780-A1 | AMINOALCOHOL COMPOUNDS AND THEIR USE AS ZERO OR LOW VOC ADDITIVES FOR PAINTS AND COATINGS | ANGUS Chemical Company (US) | 2019-09-04 | — | — | EP | disclosed |
| EP-2714644-B1 | AMINOALCOHOL COMPOUNDS AND THEIR USE AS ZERO OR LOW VOC ADDITIVES FOR PAINTS AND COATINGS | ANGUS CHEMICAL (US) | 2019-03-13 | — | — | EP | disclosed |
| WO-2013016270-A1 | AMINOALCOHOL COMPOUNDS AND THEIR USE AS ZERO OR LOW VOC ADDITIVES FOR PAINTS AND COATINGS | ANGUS CHEMICAL COMPANY (US) | 2013-01-31 | — | — | WO | disclosed |