⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3687235 | 0.68 | — | — | |
| SCHEMBL3681243 | 0.68 | — | — | |
| SCHEMBL14781409 | 0.67 | — | — | |
| SCHEMBL10153255 | 0.62 | — | — | |
| SCHEMBL11888134 | 0.55 | — | — | |
| SCHEMBL14828375 | 0.55 | — | — | |
| SCHEMBL10339840 | 0.53 | — | — | |
| SCHEMBL9998063 | 0.52 | — | — | |
| SCHEMBL1668401 | 0.48 | — | — | |
| SCHEMBL2074977 | 0.47 | MAPK1 (0.35) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115093341-B | 2-cyclopentene-1-alcohol derivative and synthetic method and application thereof | 江西省科学院应用化学研究所 | 2024-03-08 | — | — | CN | disclosed |
| CN-115093341-A | 2-cyclopentene-1-alcohol derivative and synthesis method and application thereof | 江西省科学院应用化学研究所 | 2022-09-23 | — | — | CN | disclosed |
| CN-104193676-B | Prepare method and the synthetic intermediate thereof of compound | 克洛维斯肿瘤学意大利公司 | 2016-08-17 | — | — | CN | disclosed |