⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25861336 | 0.80 | — | — | |
| SCHEMBL2522581 | 0.72 | — | — | |
| SCHEMBL25463549 | 0.72 | CYP1A2 (0.30) | — | |
| SCHEMBL11233487 | 0.71 | — | — | |
| SCHEMBL16022795 | 0.71 | — | — | |
| SCHEMBL9799364 | 0.71 | — | — | |
| SCHEMBL4939024 | 0.70 | TET2 (0.37) | — | |
| SCHEMBL28433369 | 0.69 | TDP1 (0.35) | — | |
| SCHEMBL20712876 | 0.69 | — | — | |
| SCHEMBL23419585 | 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 |
|---|---|---|---|---|---|---|---|
| EP-0025846-B1 | IMPROVED PROCESS FOR THE PREPARATION OF VINYLCYCLOPROPANE DERIVATIVES | NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) | 1984-03-07 | — | — | EP | claimed |
| EP-0025846-B1 | IMPROVED PROCESS FOR THE PREPARATION OF VINYLCYCLOPROPANE DERIVATIVES | NATIONAL DISTILLERS AND CHEMICAL CORPORATION (US) | 1984-03-07 | — | — | EP | disclosed |