⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3761267 | 0.63 | — | — | |
| SCHEMBL3507793 | 0.61 | CYP2D6 (0.35) | — | |
| SCHEMBL4124438 | 0.59 | — | — | |
| SCHEMBL4779298 | 0.59 | — | — | |
| SCHEMBL11052234 | 0.59 | — | — | |
| SCHEMBL11056188 | 0.58 | — | — | |
| SCHEMBL11129288 | 0.57 | — | — | |
| SCHEMBL867263 | 0.57 | ALDH1A1 (0.44) | — | |
| SCHEMBL867262 | 0.57 | ALDH1A1 (0.44) | — | |
| SCHEMBL4109909 | 0.57 | ALDH1A1 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6559243-B1 | Glyoxylic compound comprising one or more active ingredient by the present invention, a delayed release of the active ingredient is provided upon contact of the compound with an aqueous medium fragrance for detergents | THE PROCTER & GAMBLE COMPANY | 2003-05-06 | — | — | US | disclosed |
| EP-1019444-A1 | GLYOXYLIC COMPOUND COMPRISING ONE OR MORE ACTIVE INGREDIENT | THE PROCTER & GAMBLE COMPANY (US) | 2000-07-19 | — | — | EP | disclosed |
| WO-1999016804-A1 | GLYOXYLIC COMPOUND COMPRISING ONE OR MORE ACTIVE INGREDIENT | THE PROCTER & GAMBLE COMPANY (US) | 1999-04-08 | — | — | WO | disclosed |
| WO-1999016801-A1 | GLYOXYLIC COMPOUND COMPRISING ONE OR MORE ACTIVE INGREDIENT | THE PROCTER & GAMBLE COMPANY (US) | 1999-04-08 | — | — | WO | disclosed |