⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4136354 | 0.61 | — | — | |
| Ethyne SCHEMBL15388351 | 0.58 | — | — | |
| Ethyne SCHEMBL15388778 | 0.58 | — | — | |
| SCHEMBL407603 | 0.58 | — | — | |
| SCHEMBL34874 | 0.55 | — | — | |
| SCHEMBL6392835 | 0.55 | — | — | |
| SCHEMBL8380791 | 0.55 | — | — | |
| SCHEMBL350583 | 0.50 | — | — | |
| SCHEMBL1276596 | 0.50 | — | — | |
| SCHEMBL1173907 | 0.50 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050187194-A1 | Preventive agents for diabetes mellitus | SANKYO COMPANY LIMITED (JP) | 2005-08-25 | — | — | US | disclosed |
| EP-1535630-A1 | PREVENTIVE FOR THE ONSET OF DIABETES | Sankyo Company, Limited (JP) | 2005-06-01 | — | — | EP | disclosed |
| US-4094886-A | Process for producing allyl alcohol derivatives useful in prostaglandin synthesis | (ZAIDANHOJIN) SAGAMI CHEMICAL RESEARCH CENTER (JA) | 1978-06-13 | — | — | US | disclosed |