⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11685172 | 0.78 | — | — | |
| SCHEMBL12220738 | 0.74 | — | — | |
| SCHEMBL5529311 | 0.72 | NPSR1 (0.41) | — | |
| SCHEMBL18116966 | 0.69 | GPR6 (0.35) | — | |
| SCHEMBL5585931 | 0.66 | GPR6 (0.56) | — | |
| SCHEMBL3115822 | 0.66 | HSD17B3 (0.60) | — | |
| SCHEMBL30529514 | 0.66 | HSD17B3 (0.60) | — | |
| SCHEMBL3123660 | 0.66 | NOTUM (0.39) | — | |
| SCHEMBL11729889 | 0.65 | KLK5 (0.42) | — | |
| SCHEMBL690903 | 0.64 | — | — |
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-3272911-B1 | INDIUM ELECTROPLATING COMPOSITIONS CONTAINING 2-IMIDAZOLIDINETHIONE COMPOUNDS AND METHODS FOR ELECTROPLATING INDIUM | ROHM & HAAS ELECT MAT (US) | 2019-08-28 | — | — | EP | claimed |