⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9823101 | 0.83 | — | — | |
| SCHEMBL4076609 | 0.72 | — | — | |
| SCHEMBL10644094 | 0.69 | TSHR (0.33) | — | |
| Bromide SCHEMBL10648209 | 0.64 | — | — | |
| SCHEMBL3914836 | 0.63 | — | — | |
| SCHEMBL8019673 | 0.63 | — | — | |
| SCHEMBL4081291 | 0.63 | — | — | |
| Bromide SCHEMBL11278587 | 0.62 | — | — | |
| SCHEMBL4073752 | 0.61 | — | — | |
| SCHEMBL3480982 | 0.60 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0675878-B1 | NOVEL VITAMIN D ANALOGUES | LEO PHARM PROD LTD (DK) | 1997-01-29 | — | — | EP | disclosed |
| EP-0675878-A1 | NOVEL VITAMIN D ANALOGUES. | LEO PHARM PROD LTD (DK) | 1995-10-11 | — | — | EP | disclosed |
| WO-1994014766-A1 | NOVEL VITAMIN D ANALOGUES | Leo Pharmaceutical Products Ltd. A/S (Løvens Kemiske Fabrik Produktionsaktieselskab) (DK) | 1994-07-07 | — | — | WO | disclosed |
| EP-0479871-A1 | NOVEL VITAMIN D ANALOGUES. | LEO PHARM PROD LTD (DK) | 1992-04-15 | — | — | EP | disclosed |