⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3070371 | 0.97 | ALDH1A1 (0.55) | — | |
| SCHEMBL27796 | 0.97 | — | — | |
| SCHEMBL2047002 | 0.94 | — | — | |
| SCHEMBL21580547 | 0.94 | — | — | |
| SCHEMBL11123022 | 0.94 | — | — | |
| SCHEMBL25232908 | 0.94 | — | — | |
| Ethylene Glycol SCHEMBL7784600 | 0.94 | ALDH1A1 (0.52) | — | |
| Water SCHEMBL58538 | 0.94 | — | — | |
| SCHEMBL4951741 | 0.94 | ALDH1A1 (0.56) | — | |
| SCHEMBL28479570 | 0.94 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20130183408-A1 | POLYETHYLENE GLYCOL LACTID COATING ON FRESH EGG | Gurbuz, OZAN . (US) | 2013-07-18 | — | — | US | disclosed |