⚠ 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 | |
|---|---|---|---|---|
| Dimethylaminoethanol SCHEMBL13169672 | 0.96 | — | — | |
| Dimethylaminoethanol SCHEMBL2149038 | 0.96 | MAPT (1.00) | — | |
| Dimethylaminoethanol SCHEMBL5945 | 0.96 | — | — | |
| Dimethylaminoethanol SCHEMBL16756236 | 0.96 | — | — | |
| Dimethylaminoethanol SCHEMBL25210984 | 0.92 | — | — | |
| Dimethylaminoethanol SCHEMBL67457 | 0.92 | — | — | |
| Dimethylaminoethanol SCHEMBL11297201 | 0.92 | — | — | |
| Dimethylaminoethanol SCHEMBL1395027 | 0.92 | — | — | |
| Dimethylaminoethanol SCHEMBL8373064 | 0.92 | — | — | |
| Dimethylaminoethanol SCHEMBL7931712 | 0.92 | MAPT (0.92) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1469746-A2 | MODULAR SYSTEM OF DIETARY SUPPLEMENT COMPOSITIONS COMPRISING VITAMINS | Meijer, Jaap (NL) | 2004-10-27 | — | — | EP | disclosed |
| WO-2002076436-A2 | MODULAR SYSTEM OF DIETARY SUPPLEMENT COMPOSITIONS COMPRISING VITAMINS | MEIJER JAAP (NL) | 2002-10-03 | — | — | WO | disclosed |