⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14421009 | 1.00 | — | — | |
| SCHEMBL14421005 | 1.00 | — | — | |
| SCHEMBL14421011 | 0.90 | — | — | |
| SCHEMBL14421006 | 0.90 | — | — | |
| SCHEMBL13843886 | 0.84 | — | — | |
| SCHEMBL14469751 | 0.84 | — | — | |
| SCHEMBL14469754 | 0.76 | — | — | |
| SCHEMBL14421015 | 0.76 | — | — | |
| SCHEMBL14469749 | 0.76 | — | — | |
| SCHEMBL13843885 | 0.73 | — | — |
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-20070244072-A1 | 1a-Hydroxy-2-(3'-Hydroxypropylidene)-19-nor-vitamin D compounds and methods of making and treatment thereof | WISCONSIN ALUMNI RESEARCH FOUNDATION | 2007-10-18 | — | — | US | disclosed |
| US-20070238703-A1 | 1alpha-Hydroxy-2-(3'-Hydroxypropylidene)-19-Nor-Vitamin D Compounds with a 1,1-Dimethylpropyl Side Chain | WISCONSIN ALUMNI RESEARCH FOUNDATION | 2007-10-11 | — | — | US | disclosed |
| US-7241747-B2 | 2-propylidene-19-nor-vitamin D compounds | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2007-07-10 | — | — | US | disclosed |