⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9054508 | 0.76 | — | — | |
| SCHEMBL11812673 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL9152818 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL9495397 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL9495401 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL9492962 | 0.65 | — | — | |
| SCHEMBL9053887 | 0.65 | ALDH1A1 (0.39) | — | |
| SCHEMBL9492878 | 0.63 | — | — | |
| SCHEMBL9053923 | 0.62 | LMNA (0.48) | — | |
| SCHEMBL10383854 | 0.54 | ALDH1A1 (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 |
|---|---|---|---|---|---|---|---|
| EP-0508955-B1 | Use of 2-iminothiazolidin-4-one derivatives as new medicaments | CIBA GEIGY AG (CH) | 1996-06-19 | — | — | EP | claimed |