⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13493080 | 0.77 | — | — | |
| SCHEMBL1082001 | 0.77 | — | — | |
| SCHEMBL5606321 | 0.77 | — | — | |
| SCHEMBL28762239 | 0.74 | — | — | |
| SCHEMBL18300921 | 0.74 | — | — | |
| SCHEMBL21032978 | 0.72 | — | — | |
| SCHEMBL14423186 | 0.71 | — | — | |
| SCHEMBL4247193 | 0.71 | LMNA (0.35) | — | |
| SCHEMBL1003884 | 0.69 | — | — | |
| SCHEMBL1003883 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2007137410-A1 | BIOMARKERS FOR DIAGNOSING MULTIPLE SCLEROSIS, AND METHODS THEREOF | PHENOMENOME DISCOVERIES INC. (CA) | 2007-12-06 | — | — | WO | disclosed |