⚠ 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 | |
|---|---|---|---|---|
| Ethane SCHEMBL27849091 | 1.00 | — | — | |
| Ethane SCHEMBL119366 | 0.82 | — | — | |
| Ethane SCHEMBL45 | 0.82 | — | — | |
| Ethane SCHEMBL11324909 | 0.82 | — | — | |
| Ethane SCHEMBL11665218 | 0.82 | — | — | |
| Ethane SCHEMBL23044683 | 0.67 | — | — | |
| Ethane SCHEMBL10894685 | 0.67 | — | — | |
| Ethane SCHEMBL9146436 | 0.67 | — | — | |
| Ethane SCHEMBL6115334 | 0.67 | — | — | |
| Ethane SCHEMBL22691971 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-4364194-A | — | — | None | — | — | JP | disclosed |
| JP-H04364194-A | PRODUCTION OF ORGANIC BISGERMYLETHANES | AGENCY OF IND SCIENCE & TECHNOL | 1992-12-16 | — | — | JP | disclosed |