⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15693693 | 0.82 | TSHR (0.44) | — | |
| SCHEMBL4578801 | 0.82 | TSHR (0.44) | — | |
| SCHEMBL4168233 | 0.82 | TSHR (0.44) | — | |
| SCHEMBL9151439 | 0.81 | ALDH1A1 (0.41) | — | |
| SCHEMBL5143214 | 0.78 | — | — | |
| SCHEMBL3783190 | 0.78 | — | — | |
| SCHEMBL15095421 | 0.78 | ALDH1A1 (0.46) | — | |
| SCHEMBL22187120 | 0.78 | — | — | |
| SCHEMBL17718476 | 0.78 | — | — | |
| SCHEMBL162836 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4847285-A | 1-substituted phenyl-3-substituted methyl-pyrrolidine-2,5-diones and plant fungicide compositions containing same | THE DOW CHEMICAL COMPANY (US) | 1989-07-11 | — | — | US | disclosed |