⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL191797 | 0.80 | — | — | |
| SCHEMBL2594932 | 0.78 | — | — | |
| SCHEMBL597407 | 0.78 | — | — | |
| SCHEMBL191629 | 0.76 | LPL (0.39) | — | |
| SCHEMBL2299951 | 0.75 | AGXT (0.31) | — | |
| SCHEMBL193524 | 0.73 | SKP2 (0.44) | — | |
| SCHEMBL192631 | 0.73 | PYCR1 (0.32) | — | |
| SCHEMBL192638 | 0.73 | ALDH1A1 (0.44) | — | |
| SCHEMBL597601 | 0.72 | — | — | |
| SCHEMBL193020 | 0.72 | PYCR1 (0.30) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8114886-B2 | Pyridylmethylsulfone derivative | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2012-02-14 | — | — | US | disclosed |
| US-20090149439-A1 | PYRIDYLMETHYSULFONE DERIVATIVE | DAIICHI SANKYO COMPANY LIMITED (JP) | 2009-06-11 | — | — | US | disclosed |
| EP-1867636-A1 | PYRIDYLMETHYLSULFONE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2007-12-19 | — | — | EP | disclosed |