⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL811643 | 1.00 | — | — | |
| SCHEMBL7137252 | 1.00 | — | — | |
| SCHEMBL11425937 | 0.93 | — | — | |
| SCHEMBL13677470 | 0.84 | — | — | |
| SCHEMBL733510 | 0.84 | — | — | |
| SCHEMBL8495053 | 0.76 | GLA (0.37) | — | |
| SCHEMBL35718 | 0.72 | — | — | |
| SCHEMBL7718818 | 0.72 | — | — | |
| SCHEMBL8505902 | 0.72 | — | — | |
| SCHEMBL31146782 | 0.70 | HRH2 (0.35) | — |
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-118724665-A | Method for constructing chiral alcohol by asymmetric hydrogenation of conjugated ketene | 深圳格林凯特医药技术有限公司 | 2024-10-01 | — | — | CN | disclosed |
| EP-0972762-B1 | Novel structural analogues of vitamin D | THERAMEX (MC) | 2003-10-01 | — | — | EP | disclosed |
| US-6548715-B1 | Which lacks the combined presence of the trans-fused ring; increased therapeutic potential; for cell proliferation; veterinary medicine | LABORATOIRE THERAMEX S.A. (MC) | 2003-04-15 | — | — | US | disclosed |
| US-6017907-A | Structural analogues of vitamin D | LABORATOIRE THERAMEX S.A. (MC) | 2000-01-25 | — | — | US | disclosed |
| EP-0972762-A2 | Novel structural analogues of vitamin D | LABORATOIRE THERAMEX (MC) | 2000-01-19 | — | — | EP | disclosed |
| EP-0707566-A1 | NOVEL STRUCTURAL ANALOGUES OF VITAMIN D | LABORATOIRE THERAMEX S.A. (MC) | 1996-04-24 | — | — | EP | disclosed |
| WO-1995001960-A1 | NOVEL STRUCTURAL ANALOGUES OF VITAMIN D | LABORATOIRE THERAMEX S.A. (MC) | 1995-01-19 | — | — | WO | disclosed |