⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2231256 | 1.00 | — | — | |
| SCHEMBL18598932 | 1.00 | — | — | |
| SCHEMBL2930784 | 1.00 | — | — | |
| SCHEMBL980075 | 1.00 | — | — | |
| SCHEMBL9706543 | 0.80 | — | — | |
| SCHEMBL13176647 | 0.79 | — | — | |
| SCHEMBL6299919 | 0.76 | POLB (0.30) | — | |
| SCHEMBL1318886 | 0.76 | — | — | |
| SCHEMBL19326370 | 0.75 | — | — | |
| SCHEMBL19321592 | 0.75 | ALDH1A1 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7635572-B2 | Methods for conducting assays for enzyme activity on protein microarrays | Life Technologies Corporation (US) | 2009-12-22 | — | — | US | disclosed |
| US-20050118665-A1 | Methods for conducting assays for enzyme activity on protein microarrays | PROTOMETRIX, INC. | 2005-06-02 | — | — | US | disclosed |