⚠ 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 | |
|---|---|---|---|---|
| Butane SCHEMBL9135838 | 0.87 | MCL1 (0.37) | — | |
| SCHEMBL62916 | 0.84 | — | — | |
| Methane SCHEMBL8513662 | 0.81 | — | — | |
| SCHEMBL1704415 | 0.69 | — | — | |
| Bicarbonate SCHEMBL9120599 | 0.67 | — | — | |
| Biphenyl SCHEMBL7216507 | 0.67 | DHODH (0.46) | — | |
| SCHEMBL8549252 | 0.67 | ALDH1A1 (0.52) | — | |
| SCHEMBL29172341 | 0.67 | — | — | |
| SCHEMBL9768585 | 0.67 | — | — | |
| SCHEMBL29172343 | 0.67 | — | — |
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-5059601-A | IMIDAZOLONE DERIVATIVES WITH ACTIVITY ON CENTRAL NERVOUS SYSTEM AND ANTIHYPERTENSIVE ACTIVITY, PREPARATION METHODS THEREOF, AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ISTITUTO LUSOFARMACO D'ITALIA S.P.A. (IT) | 1991-10-22 | — | — | US | disclosed |
| EP-0379990-A1 | Imidazolone derivatives with activity on central nervous system and antihypertensive activity, preparation methods thereof, and pharmaceutical compositions containing them | ISTITUTO LUSO FARMACO D'ITALIA S.p.A. (IT) | 1990-08-01 | — | — | EP | disclosed |