⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8999310 | 0.85 | — | — | |
| SCHEMBL6430680 | 0.74 | — | — | |
| SCHEMBL14298961 | 0.74 | — | — | |
| SCHEMBL18095414 | 0.74 | — | — | |
| Bromide SCHEMBL28731653 | 0.72 | — | — | |
| SCHEMBL10909906 | 0.72 | — | — | |
| SCHEMBL8745348 | 0.70 | — | — | |
| SCHEMBL9166158 | 0.70 | — | — | |
| SCHEMBL8406935 | 0.69 | — | — | |
| SCHEMBL7928079 | 0.69 | TSHR (0.45) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113956133-B | Method for synthesizing 25-hydroxy steroid compound, method for preparing side chain thereof and method for preparing side chain intermediate | 湖南科瑞生物制药股份有限公司 | 2025-01-28 | — | — | CN | disclosed |
| CN-113956133-A | Synthesis method of 25-hydroxy steroid compound, preparation method of side chain thereof and preparation method of side chain intermediate | 湖南科瑞生物制药股份有限公司 | 2022-01-21 | — | — | CN | disclosed |
| EP-0572489-B1 | STARTING COMPOUNDS FOR PREPARING CALCITRIOL AND ITS DERIVATIVES, METHOD FOR PREPARING THESE STARTING COMPOUNDS AND INTERMEDIATE PRODUCTS FOR THIS METHOD | JENAPHARM GMBH (DE) | 1996-09-04 | — | — | EP | disclosed |
| EP-0402982-B1 | Adduct-aldehyde and its use for the preparation of a vitamin-D compound | DUPHAR INT RES (NL) | 1994-01-05 | — | — | EP | disclosed |
| WO-1992014746-A1 | STARTING COMPOUNDS FOR PREPARING CALCITRIOL AND ITS DERIVATIVES, METHOD FOR PREPARING THESE STARTING COMPOUNDS AND INTERMEDIATE PRODUCTS FOR THIS METHOD | JENAPHARM GMBH (DE) | 1992-09-03 | — | — | WO | disclosed |
| US-5110924-A | ADDUCT-ALDEHYDE AND ITS USE FOR THE PREPARATION OF VITAMIN-D COMPOUNDS | DUPHAR INTERNATIONAL RESEARCH B.V. (NL) | 1992-05-05 | — | — | US | disclosed |
| EP-0402982-A1 | Adduct-aldehyde and its use for the preparation of a vitamin-D compound | DUPHAR INTERNATIONAL RESEARCH B.V (NL) | 1990-12-19 | — | — | EP | disclosed |