⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31749181 | 0.85 | — | — | |
| SCHEMBL30503593 | 0.78 | CCNE2 (0.30) | — | |
| SCHEMBL29268030 | 0.68 | PIK3CB (0.33) | — | |
| SCHEMBL30322466 | 0.67 | DDB1 (0.39) | — | |
| SCHEMBL23993485 | 0.63 | MTNR1A (0.31) | — | |
| SCHEMBL30224531 | 0.63 | MTNR1A (0.31) | — | |
| SCHEMBL25425541 | 0.61 | HTR7 (0.38) | — | |
| SCHEMBL21285447 | 0.60 | PDE2A (0.31) | — | |
| SCHEMBL22822703 | 0.60 | AURKA (0.36) | — | |
| SCHEMBL31324653 | 0.60 | AURKA (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116444523-A | Compounds as SMARCA2 inhibitors and uses thereof | 南京圣和药业股份有限公司 | 2023-07-18 | — | — | CN | disclosed |
| CN-116323557-A | Cyclobutylamide monoacylglycerol lipase modulators | 詹森药业有限公司 | 2023-06-23 | — | — | CN | disclosed |