⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10719706 | 0.74 | — | — | |
| SCHEMBL3290890 | 0.71 | LMNA (0.31) | — | |
| SCHEMBL7639194 | 0.71 | LMNA (0.31) | — | |
| SCHEMBL7492412 | 0.71 | — | — | |
| SCHEMBL6676961 | 0.71 | — | — | |
| SCHEMBL7492414 | 0.71 | — | — | |
| SCHEMBL16606334 | 0.71 | — | — | |
| SCHEMBL20150641 | 0.71 | — | — | |
| SCHEMBL4347890 | 0.62 | CA1 (0.30) | — | |
| SCHEMBL12745796 | 0.62 | APEX1 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1240137-B1 | METHOD FOR MAKING 24(S)-HYDROXYVITAMIN D 2 | BONE CARE INT INC (US) | 2004-06-09 | — | — | EP | claimed |
| EP-1240137-A1 | METHOD FOR MAKING 24(S)-HYDROXYVITAMIN D 2 | BONE CARE INTERNATIONAL, INC. (US) | 2002-09-18 | — | — | EP | claimed |
| WO-2001046131-A1 | METHOD FOR MAKING 24(S)-HYDROXYVITAMIN D¿2? | BONE CARE INTERNATIONAL, INC. (US) | 2001-06-28 | — | — | WO | claimed |
| EP-1240137-B1 | METHOD FOR MAKING 24(S)-HYDROXYVITAMIN D 2 | BONE CARE INT INC (US) | 2004-06-09 | — | — | EP | disclosed |
| EP-1240137-A1 | METHOD FOR MAKING 24(S)-HYDROXYVITAMIN D 2 | BONE CARE INTERNATIONAL, INC. (US) | 2002-09-18 | — | — | EP | disclosed |
| US-6359012-B1 | COUPLING 2,3-DIMETHYL-2-TRIETHYLSILYLOXYBUTYRALDEHYDE AND A C-22 VITAMIN D PHOSPHINE OXIDE DERIVATIVE TO FORM A 3,24-DIPROTECTED TRANS-VITAMIN D2; DEPROTECTING AND ISOMERIZING | BONE CARE INTERNATIONAL, INC. | 2002-03-19 | — | — | US | disclosed |
| WO-2001046131-A1 | METHOD FOR MAKING 24(S)-HYDROXYVITAMIN D¿2? | BONE CARE INTERNATIONAL, INC. (US) | 2001-06-28 | — | — | WO | disclosed |