⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1332571 | 0.83 | — | — | |
| Charcoal, Activated SCHEMBL8437009 | 0.60 | TSHR (0.38) | — | |
| SCHEMBL13629 | 0.60 | — | — | |
| SCHEMBL20546841 | 0.60 | ALDH1A1 (0.47) | — | |
| Water SCHEMBL2471733 | 0.58 | — | — | |
| SCHEMBL1435270 | 0.58 | — | — | |
| Ammonia Solution, Strong SCHEMBL5487462 | 0.58 | — | — | |
| Ethylene SCHEMBL5491453 | 0.58 | — | — | |
| SCHEMBL1492506 | 0.56 | — | — | |
| SCHEMBL64894 | 0.56 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1709127-A1 | LATEX PAINT COMPOSITIONS AND COATINGS | 3M Innovative Properties Company (US) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005066295-A1 | LATEX PAINT COMPOSITIONS AND COATINGS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2005-07-21 | — | — | WO | disclosed |
| EP-1525268-A1 | FUNCTIONAL FLUORESCENT DYES | 3M Innovative Properties Company (US) | 2005-04-27 | — | — | EP | disclosed |
| EP-1525240-A1 | DYED FLUOROPOLYMERS | 3M Innovative Properties Company (US) | 2005-04-27 | — | — | EP | disclosed |
| WO-2004011512-A1 | DYED FLUOROPOLYMERS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2004-02-05 | — | — | WO | disclosed |
| WO-2004011557-A1 | FUNCTIONAL FLUORESCENT DYES | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2004-02-05 | — | — | WO | disclosed |