⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7427181 | 0.77 | DGAT1 (0.31) | — | |
| SCHEMBL7442015 | 0.68 | — | — | |
| SCHEMBL7448330 | 0.67 | — | — | |
| SCHEMBL7438466 | 0.66 | — | — | |
| SCHEMBL7438667 | 0.62 | MAPT (0.36) | — | |
| SCHEMBL30546687 | 0.61 | — | — | |
| SCHEMBL14385386 | 0.60 | DGAT1 (0.34) | — | |
| SCHEMBL28850438 | 0.59 | SLC15A1 (0.32) | — | |
| SCHEMBL15824082 | 0.58 | TSHR (0.32) | — | |
| SCHEMBL7439027 | 0.57 | DGAT1 (0.32) | — |
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-6066666-A | OPTIONALLY N-SUBSTITUTED 3-MONO- AND DI-SUBSTITUTED 2-PYRROLIDINONES AND THIOLACTAM ANALOGS; TREAT SEIZURES, ANXIETY, AND ENHANCING 4-AMINOBUTYRIC ACID (GABA)-INDUCED CHLORIDE CURRENTS AT GABA RECEPTOR/IONOPHORE COMPLEX | WASHINGTON UNIVERSITY (US) | 2000-05-23 | — | — | US | disclosed |
| US-5776959-A | Anticonvulsant and anxiolytic lactam and thiolactam derivatives | WASHINGTON UNIVERSITY (US) | 1998-07-07 | — | — | US | disclosed |