⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25401885 | 0.77 | — | — | |
| SCHEMBL2015785 | 0.77 | — | — | |
| SCHEMBL1982143 | 0.77 | — | — | |
| SCHEMBL27798808 | 0.72 | FLT1 (0.35) | — | |
| SCHEMBL19151429 | 0.72 | NPSR1 (0.35) | — | |
| SCHEMBL16608254 | 0.70 | GRM4 (0.64) | — | |
| SCHEMBL9324362 | 0.70 | GRM4 (0.64) | — | |
| SCHEMBL30629338 | 0.69 | — | — | |
| SCHEMBL108558 | 0.69 | — | — | |
| SCHEMBL2520312 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022268520-A1 | USE OF SUBSTITUTED PYRROLIDINONES OR THEIR SALTS FOR INCREASING STRESS TOLERANCE OF PLANTS | BAYER AKTIENGESELLSCHAFT (DE) | 2022-12-29 | — | — | WO | disclosed |
| US-7560464-B2 | Polycyclic pyrimidines as potassium ion channel modulators | ICAGEN, INC. (US) | 2009-07-14 | — | — | US | disclosed |