⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2797473 | 0.82 | SCN5A (0.30) | — | |
| SCHEMBL2795451 | 0.74 | LIPG (0.30) | — | |
| SCHEMBL2794635 | 0.72 | PIK3CD (0.32) | — | |
| SCHEMBL13262658 | 0.72 | LIPC (0.31) | — | |
| SCHEMBL2798061 | 0.70 | LIPG (0.32) | — | |
| SCHEMBL2796376 | 0.69 | LIPC (0.34) | — | |
| SCHEMBL13262488 | 0.66 | LIPC (0.36) | — | |
| SCHEMBL2795101 | 0.66 | LIPC (0.35) | — | |
| SCHEMBL13262583 | 0.66 | — | — | |
| SCHEMBL2794552 | 0.65 | LIPC (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2204365-A1 | ALKYLSULFONE DERIVATIVE | Daiichi Sankyo Company, Limited (JP) | 2010-07-07 | — | — | EP | disclosed |
| US-20100168136-A1 | ALKYLSULFONE DERIVATIVES | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2010-07-01 | — | — | US | disclosed |
| US-20100168136-A1 | ALKYLSULFONE DERIVATIVES | DAIICHI SANKYO COMPANY, LIMITED (JP) | 2010-07-01 | — | — | US | disclosed |