⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4757035 | 0.57 | — | — | |
| SCHEMBL3110422 | 0.51 | — | — | |
| Hydrochloric Acid SCHEMBL5711419 | 0.50 | — | — | |
| SCHEMBL19677603 | 0.47 | — | — | |
| SCHEMBL13651940 | 0.45 | — | — | |
| Iodide SCHEMBL1537060 | 0.42 | — | — | |
| SCHEMBL369355 | 0.42 | — | — | |
| SCHEMBL21290178 | 0.42 | KDM4E (0.32) | — | |
| SCHEMBL22211299 | 0.42 | — | — | |
| SCHEMBL12440758 | 0.41 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090247579-A1 | 2-[3H-THIAZOL-2-YLIDINEMETHYL]PYRIDINES AND RELATED COMPOUNDS AND THEIR USE | CANCER RESEARCH TECHNOLOGY LIMITED | 2009-10-01 | — | — | US | disclosed |