⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2115713 | 0.63 | — | — | |
| SCHEMBL9550046 | 0.62 | KDM4E (0.31) | — | |
| Hydrochloric Acid SCHEMBL18281396 | 0.60 | KDM4E (0.34) | — | |
| SCHEMBL18208876 | 0.60 | — | — | |
| SCHEMBL1676006 | 0.60 | — | — | |
| SCHEMBL30674421 | 0.59 | HRH3 (0.43) | — | |
| SCHEMBL27912053 | 0.58 | HRH3 (0.39) | — | |
| SCHEMBL3323609 | 0.58 | — | — | |
| SCHEMBL7973334 | 0.58 | CA2 (0.44) | — | |
| SCHEMBL15556860 | 0.57 | CASP3 (0.33) | — |
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-2197876-A1 | THIAZOLE AND OXAZOLE KINASE INHIBITORS | Glaxosmithkline LLC (US) | 2010-06-23 | — | — | EP | disclosed |
| WO-2009032667-A1 | THIAZOLE AND OXAZOLE KINASE INHIBITORS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-03-12 | — | — | WO | disclosed |