⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9221482 | 0.76 | — | — | |
| SCHEMBL9404124 | 0.65 | — | — | |
| SCHEMBL9222939 | 0.65 | — | — | |
| SCHEMBL384408 | 0.64 | — | — | |
| SCHEMBL10877482 | 0.61 | — | — | |
| SCHEMBL524074 | 0.61 | — | — | |
| SCHEMBL25267127 | 0.59 | — | — | |
| SCHEMBL4077234 | 0.59 | — | — | |
| SCHEMBL6668050 | 0.57 | — | — | |
| SCHEMBL7047581 | 0.57 | TSHR (0.30) | — |
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-5391794-A | A trissilylalkane compound is formed by hydrosilation in presence of catalysts and cyclohexene; coupling agent between filler and rubber polymer | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 1995-02-21 | — | — | US | disclosed |
| US-5338876-A | Reacting silicon with alkenyl chloride and alkyl or hydrogen chloride using copper catalyst | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KIST) (KR) | 1994-08-16 | — | — | US | disclosed |