⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9949788 | 0.80 | — | — | |
| SCHEMBL910893 | 0.79 | — | — | |
| SCHEMBL7074482 | 0.79 | — | — | |
| SCHEMBL9949443 | 0.75 | — | — | |
| SCHEMBL14706491 | 0.71 | — | — | |
| SCHEMBL910778 | 0.71 | — | — | |
| SCHEMBL9949441 | 0.69 | — | — | |
| SCHEMBL910777 | 0.67 | — | — | |
| SCHEMBL9948960 | 0.67 | — | — | |
| SCHEMBL9950349 | 0.67 | — | — |
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-2479159-A1 | PREPARATION METHOD FOR COMPOUND PROVIDED WITH DOUBLE BOND | Sumitomo Chemical Co., Ltd (JP) | 2012-07-25 | — | — | EP | disclosed |
| US-20120165587-A1 | Method for Producing a Compound with a Double Bond | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2012-06-28 | — | — | US | disclosed |