⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21030075 | 1.00 | — | — | |
| SCHEMBL11364472 | 1.00 | — | — | |
| Water SCHEMBL17352289 | 0.94 | FUCA1 (0.42) | — | |
| SCHEMBL17102911 | 0.88 | FUCA1 (0.39) | — | |
| Sulfuric Acid SCHEMBL17352290 | 0.82 | FUCA1 (0.34) | — | |
| SCHEMBL24168463 | 0.80 | — | — | |
| SCHEMBL11261311 | 0.80 | — | — | |
| SCHEMBL11050196 | 0.78 | FUCA1 (0.40) | — | |
| SCHEMBL11265925 | 0.77 | — | — | |
| SCHEMBL3962590 | 0.77 | FUCA1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4294973-A | Process for the preparation of diacylated 4-imidazolin-2-ones | BAYER AKTIENGESELLSCHAFT (DE) | 1981-10-13 | — | — | US | disclosed |
| US-4238618-A | Process for the preparation of diacylated 4-imidazolin-2-ones | BAYER AKTIENGESELLSCHAFT (DE) | 1980-12-09 | — | — | US | disclosed |