⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5758196 | 1.00 | — | — | |
| SCHEMBL5757217 | 0.83 | IDO1 (0.36) | — | |
| SCHEMBL6746374 | 0.83 | IDO1 (0.36) | — | |
| SCHEMBL6746322 | 0.81 | CYP1A2 (0.30) | — | |
| SCHEMBL6746347 | 0.81 | CYP1A2 (0.30) | — | |
| SCHEMBL6748030 | 0.79 | KDM5A (0.36) | — | |
| SCHEMBL6750210 | 0.79 | KDM5A (0.36) | — | |
| SCHEMBL6752552 | 0.76 | IDO1 (0.38) | — | |
| SCHEMBL6752548 | 0.76 | IDO1 (0.38) | — | |
| SCHEMBL6750129 | 0.76 | IDO1 (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1562920-B1 | ANTIINFLAMMATORY 3-ARYLTHIO-3-THIAZOLYL-ALKYLAMINES | ASTRAZENECA AB (SE) | 2006-06-28 | — | — | EP | disclosed |
| US-20060040992-A1 | Antiinflammatory 3-arylthio-3-thiazolyl-alkylamines | ASTRAZENECA AB (SE) | 2006-02-23 | — | — | US | disclosed |
| US-20040242871-A1 | Novel arylheteroalkylamine derivatives | ASTRAZENECA AB (SE) | 2004-12-02 | — | — | US | disclosed |