⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4056546 | 0.72 | — | — | |
| SCHEMBL6938209 | 0.70 | — | — | |
| SCHEMBL1867667 | 0.70 | — | — | |
| SCHEMBL6061584 | 0.66 | — | — | |
| SCHEMBL2085807 | 0.65 | — | — | |
| SCHEMBL22267857 | 0.64 | — | — | |
| SCHEMBL22958 | 0.64 | CYP2C19 (0.38) | — | |
| SCHEMBL1722705 | 0.62 | — | — | |
| SCHEMBL10439065 | 0.62 | ALDH1A1 (0.33) | — | |
| SCHEMBL2356466 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2344449-A1 | ARYL-PHENYL-SULFONAMIDO-CYCLOALKYL COMPOUNDS AND THEIR USE | Pimco 2664 Limited (GB) | 2011-07-20 | — | — | EP | disclosed |
| WO-2010032009-A1 | ARYL-PHENYL-SULFONAMIDO-CYCLOALKYL COMPOUNDS AND THEIR USE | PIMCO 2664 LIMITED (GB) | 2010-03-25 | — | — | WO | disclosed |