⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10444579 | 0.71 | — | — | |
| SCHEMBL13711260 | 0.65 | TSHR (0.32) | — | |
| SCHEMBL1455025 | 0.64 | — | — | |
| SCHEMBL1775924 | 0.64 | — | — | |
| SCHEMBL8026471 | 0.64 | — | — | |
| SCHEMBL11042501 | 0.63 | ALDH1A1 (0.32) | — | |
| SCHEMBL11043695 | 0.63 | — | — | |
| SCHEMBL11042494 | 0.63 | ALDH1A1 (0.32) | — | |
| SCHEMBL1454386 | 0.62 | — | — | |
| SCHEMBL13458953 | 0.62 | — | — |
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-2050754-B1 | Method for manufacturing alkyl-methoxymethyl-trimethylsilanylmethyl amines | WACKER CHEMIE AG (DE) | 2010-09-15 | — | — | EP | disclosed |
| EP-2050754-A1 | Method for manufacturing alkyl-methoxymethyl-trimethylsilanylmethyl amines | Wacker Chemie AG (DE) | 2009-04-22 | — | — | EP | disclosed |