⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11488729 | 0.83 | — | — | |
| SCHEMBL21176931 | 0.76 | RIPK1 (0.35) | — | |
| SCHEMBL12034018 | 0.74 | OPRM1 (0.44) | — | |
| SCHEMBL3878685 | 0.74 | TSHR (0.33) | — | |
| SCHEMBL11604925 | 0.74 | OPRM1 (0.44) | — | |
| SCHEMBL12033989 | 0.74 | OPRM1 (0.44) | — | |
| SCHEMBL4376907 | 0.74 | OPRM1 (0.44) | — | |
| SCHEMBL2020557 | 0.74 | — | — | |
| SCHEMBL9513088 | 0.74 | — | — | |
| SCHEMBL29772657 | 0.74 | — | — |
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-7456307-B2 | Preparation of a halosilylated chain hydrocarbon | DOW CORNING TORAY COMPANY, LTD. (JP) | 2008-11-25 | — | — | US | disclosed |
| US-20070055074-A1 | Preparation of a halosilylated chain hydrocarbon | DOW CORNING TORAY COMPANY, LTD. (JP) | 2007-03-08 | — | — | US | disclosed |