⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11890724 | 0.80 | — | — | |
| SCHEMBL21985045 | 0.73 | KDM4E (0.34) | — | |
| SCHEMBL19937707 | 0.72 | — | — | |
| SCHEMBL9631633 | 0.70 | — | — | |
| SCHEMBL859560 | 0.69 | — | — | |
| SCHEMBL20748844 | 0.68 | — | — | |
| SCHEMBL5536704 | 0.67 | — | — | |
| SCHEMBL19444874 | 0.67 | — | — | |
| SCHEMBL23917220 | 0.65 | ALOX5 (0.33) | — | |
| SCHEMBL22293637 | 0.65 | — | — |
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-20190210974-A1 | DIARYLHYDANTOIN COMPOUNDS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2019-07-11 | — | — | US | disclosed |
| EP-3268360-B1 | LACTAMS AS INHIBITORS OF ROCK | BRISTOL MYERS SQUIBB CO (US) | 2019-04-24 | — | — | EP | disclosed |