⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17340159 | 1.00 | — | — | |
| SCHEMBL12397933 | 0.87 | RECQL (0.31) | — | |
| SCHEMBL12397956 | 0.69 | — | — | |
| SCHEMBL17340133 | 0.68 | ESR2 (0.32) | — | |
| SCHEMBL12464753 | 0.68 | ESR2 (0.32) | — | |
| SCHEMBL3185280 | 0.66 | — | — | |
| SCHEMBL12397931 | 0.66 | ESR2 (0.34) | — | |
| SCHEMBL21057412 | 0.64 | — | — | |
| SCHEMBL21057413 | 0.64 | — | — | |
| SCHEMBL13531907 | 0.64 | ESR2 (0.38) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20110184199-A1 | Methods For Producing Paricalcitol | AZAD PHARMA AG (CH) | 2011-07-28 | — | — | US | disclosed |