⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31122080 | 0.73 | — | — | |
| SCHEMBL11867284 | 0.66 | — | — | |
| SCHEMBL19328590 | 0.65 | — | — | |
| SCHEMBL10343185 | 0.65 | — | — | |
| SCHEMBL9140298 | 0.57 | — | — | |
| SCHEMBL27250046 | 0.57 | — | — | |
| SCHEMBL13283402 | 0.57 | — | — | |
| SCHEMBL6666231 | 0.55 | — | — | |
| SCHEMBL1820868 | 0.55 | — | — | |
| SCHEMBL11226175 | 0.55 | — | — |
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-7022503-B2 | Process for the stereoselective preparation of functionalized vicinal diols | BAYER AKTIENGESELLSCHAFT (DE) | 2006-04-04 | — | — | US | disclosed |
| US-20030134401-A1 | Process for the stereoselective preparation of functionalized vicinal diols | LANXESS DEUTSCHLAND GMBH (DE) | 2003-07-17 | — | — | US | disclosed |
| EP-1291436-A1 | Process for the stereoselective preparation of functionalized vicinal diols | BAYER AG (DE) | 2003-03-12 | — | — | EP | disclosed |