⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9870768 | 0.82 | — | — | |
| SCHEMBL2261149 | 0.81 | — | — | |
| SCHEMBL6697624 | 0.81 | RAB9A (0.31) | — | |
| SCHEMBL2910902 | 0.79 | — | — | |
| SCHEMBL9205307 | 0.79 | — | — | |
| SCHEMBL28104428 | 0.76 | RAB9A (0.31) | — | |
| SCHEMBL5500128 | 0.75 | — | — | |
| SCHEMBL15272272 | 0.73 | KDM4E (0.30) | — | |
| SCHEMBL7064859 | 0.73 | — | — | |
| SCHEMBL27676412 | 0.72 | — | — |
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-20090275565-A1 | Substituted aralkyl derivatives | CADILA HEALTHCARE LIMITED (IN) | 2009-11-05 | — | — | US | disclosed |
| US-6806363-B1 | DRUGS FOR DIAGNOSIS/THERAPY; RADIONUCLIDE-BASED TUMOR IMAGING | MAYO FOUNDATION FOR MEDICAL EDUCATION & RESEARCH | 2004-10-19 | — | — | US | disclosed |