⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11801830 | 0.67 | — | — | |
| SCHEMBL22339862 | 0.65 | — | — | |
| SCHEMBL17100530 | 0.63 | — | — | |
| SCHEMBL11231408 | 0.59 | — | — | |
| SCHEMBL304420 | 0.59 | — | — | |
| SCHEMBL28396612 | 0.57 | — | — | |
| SCHEMBL333353 | 0.57 | — | — | |
| SCHEMBL30140506 | 0.57 | ALDH1A1 (0.36) | — | |
| SCHEMBL29543033 | 0.57 | ALDH1A1 (0.36) | — | |
| SCHEMBL22471875 | 0.56 | — | — |
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-1705180-B1 | Preparation methods of (organothiomethyl)chlorosilanes | KOREA INST SCI & TECH (KR) | 2011-09-14 | — | — | EP | disclosed |
| EP-1705180-A1 | (Organothiomethyl)chlorosilanes and their preparation methods | Korea Institute of Science and Technology (KR) | 2006-09-27 | — | — | EP | disclosed |