⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9171663 | 0.86 | — | — | |
| SCHEMBL6429497 | 0.78 | — | — | |
| SCHEMBL8745362 | 0.77 | — | — | |
| SCHEMBL8745303 | 0.73 | — | — | |
| SCHEMBL9166158 | 0.73 | — | — | |
| SCHEMBL9170590 | 0.71 | — | — | |
| SCHEMBL29053266 | 0.68 | — | — | |
| SCHEMBL9127732 | 0.67 | — | — | |
| SCHEMBL9168926 | 0.65 | — | — | |
| SCHEMBL8767489 | 0.64 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5401732-A | Autoimmune diseases | LEO PHARMACEUTICAL PRODUCTS LTD. A/S KEMISKE FABRIK PRODUKIONSAKTIESE SKAB (DK) | 1995-03-28 | — | — | US | disclosed |
| EP-0460032-B1 | NOVEL VITAMIN D ANALOGUES | LEO PHARM PROD LTD (DK) | 1994-04-27 | — | — | EP | disclosed |