⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL667276 | 0.95 | L3MBTL1 (0.40) | — | |
| SCHEMBL667548 | 0.95 | L3MBTL1 (0.40) | — | |
| SCHEMBL477164 | 0.95 | L3MBTL1 (0.40) | — | |
| SCHEMBL1489870 | 0.93 | L3MBTL3 (0.39) | — | |
| SCHEMBL1489616 | 0.93 | L3MBTL3 (0.39) | — | |
| SCHEMBL1489973 | 0.93 | L3MBTL3 (0.39) | — | |
| SCHEMBL7473907 | 0.86 | KDM4E (0.41) | — | |
| SCHEMBL1489996 | 0.84 | L3MBTL3 (0.38) | — | |
| SCHEMBL1833709 | 0.83 | L3MBTL3 (0.34) | — | |
| SCHEMBL192997 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2490541-A1 | 2-SUBSTITUTED-ETHYNYLTHIAZOLE DERIVATIVES AND USES OF SAME | H. Lundbeck A/S (DK) | 2012-08-29 | — | — | EP | disclosed |
| WO-2011050063-A1 | 2-SUBSTITUTED-ETHYNYLTHIAZOLE DERIVATIVES AND USES OF SAME | H. LUNDBECK A/S (DK) | 2011-04-28 | — | — | WO | disclosed |