⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8027947 | 1.00 | — | — | |
| Methane SCHEMBL28118431 | 1.00 | — | — | |
| SCHEMBL29368321 | 1.00 | — | — | |
| SCHEMBL7717809 | 1.00 | — | — | |
| SCHEMBL8860959 | 1.00 | — | — | |
| SCHEMBL15155 | 1.00 | — | — | |
| SCHEMBL29365410 | 1.00 | — | — | |
| SCHEMBL30498926 | 1.00 | — | — | |
| Water SCHEMBL2234642 | 0.71 | — | — | |
| SCHEMBL1652151 | 0.71 | — | — |
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-6025513-A | CATALYTIC REACTING A METALLIC SILICON POWDER WITH AN ALKYL HALIDE IN PRESENCE OF A COPPER CATALYST, AND ELEMENTAL BORON FOR EFFECTIVE INCREASING THE DIALKYLDIHALOSILANE PRODUCTION | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2000-02-15 | — | — | US | disclosed |