⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4796479 | 0.83 | — | — | |
| SCHEMBL705738 | 0.77 | — | — | |
| SCHEMBL918156 | 0.77 | — | — | |
| SCHEMBL148843 | 0.74 | — | — | |
| SCHEMBL8433061 | 0.73 | — | — | |
| SCHEMBL29048876 | 0.72 | — | — | |
| Butadiene SCHEMBL579958 | 0.71 | — | — | |
| SCHEMBL9490375 | 0.69 | — | — | |
| SCHEMBL11616888 | 0.69 | — | — | |
| Propene SCHEMBL29001590 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5985462-A | COATINGS, RELEASE AGENTS; HYDROSILATION; CATALYSIS | WACKER-CHEMIE GMBH (DE) | 1999-11-16 | — | — | US | disclosed |
| EP-0829518-A1 | Crosslinkable compositions containing silicon compounds having hydrogen atoms bound to silicon | Wacker-Chemie GmbH (DE) | 1998-03-18 | — | — | EP | disclosed |