⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28112023 | 0.76 | — | — | |
| SCHEMBL8928290 | 0.76 | — | — | |
| SCHEMBL4790562 | 0.75 | KDM5A (0.42) | — | |
| SCHEMBL514695 | 0.74 | — | — | |
| SCHEMBL21477741 | 0.74 | KDM5A (0.47) | — | |
| Methoxymethane SCHEMBL11422747 | 0.72 | FFAR3 (0.33) | — | |
| SCHEMBL2099259 | 0.72 | — | — | |
| SCHEMBL3940725 | 0.72 | HDAC6 (0.39) | — | |
| SCHEMBL525272 | 0.70 | — | — | |
| SCHEMBL10391621 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1268410-A1 | BETA-HYDROXY BUTENYL CARBAMATE, FUNCTIONAL OLIGOMERS AND COATINGS THEREFROM | EASTMAN CHEMICAL COMPANY (US) | 2003-01-02 | — | — | EP | disclosed |
| US-6465679-B2 | (VINYL)-2-HYDROXYETHYL CARBAMATE; OLIGOMERS WITH A POLYISOCYANATE; CURABLE COATING COMPOSITIONS WITH MELAMINE-FORMALDEHYDE RESIN; LOW SOLUTION VISCOSITY, FOR USE IN HIGH SOLIDS COATINGS | EASTMAN CHEMICAL COMPANY | 2002-10-15 | — | — | US | disclosed |
| US-20020040110-A1 | Carbamate functional oligomers and coatings therefrom | EASTMAN CHEMICAL COMPANY | 2002-04-04 | — | — | US | disclosed |
| WO-2001049658-A1 | BETA-HYDROXY BUTENYL CARBAMATE, FUNCTIONAL OLIGOMERS AND COATINGS THEREFROM | EASTMAN CHEMICAL COMPANY (US) | 2001-07-12 | — | — | WO | disclosed |