⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4305449 | 0.77 | FBP1 (0.36) | — | |
| SCHEMBL7004114 | 0.76 | — | — | |
| SCHEMBL8646100 | 0.76 | — | — | |
| SCHEMBL9503811 | 0.75 | MAOB (0.35) | — | |
| SCHEMBL14385409 | 0.73 | ALDH1A1 (0.47) | — | |
| SCHEMBL2652518 | 0.71 | — | — | |
| SCHEMBL21233056 | 0.71 | — | — | |
| SCHEMBL21241066 | 0.71 | — | — | |
| SCHEMBL12635474 | 0.70 | — | — | |
| SCHEMBL4871969 | 0.69 | KDM4E (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7358267-B2 | Bis-aryl thiazole derivatives | AMGEN INC. (US) | 2008-04-15 | — | — | US | disclosed |
| US-20050215608-A1 | Bis-aryl thiazole derivatives | AMGEN INC. | 2005-09-29 | — | — | US | disclosed |
| WO-2003002062-A2 | BIS-ARYL THIAZOLE DERIVATIVES | TULARIK INC. (US) | 2003-01-09 | — | — | WO | disclosed |