⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17058730 | 0.82 | — | — | |
| SCHEMBL1010288 | 0.79 | — | — | |
| SCHEMBL3081170 | 0.79 | MEN1 (0.58) | — | |
| SCHEMBL25908423 | 0.79 | MEN1 (0.58) | — | |
| SCHEMBL22041029 | 0.79 | MEN1 (0.58) | — | |
| SCHEMBL4400443 | 0.78 | — | — | |
| SCHEMBL8661663 | 0.78 | — | — | |
| SCHEMBL122385 | 0.77 | — | — | |
| Ethylene Glycol SCHEMBL15570614 | 0.77 | MEN1 (0.55) | — | |
| Di(Hydroxyethyl)Ether SCHEMBL15375850 | 0.75 | ALDH1A1 (0.52) | — |
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-20160272807-A1 | Polyoxymethylene Nanoparticles | TICONA GMBH (DE) | 2016-09-22 | — | — | US | disclosed |