⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22501359 | 0.72 | — | — | |
| SCHEMBL3801748 | 0.72 | — | — | |
| SCHEMBL1573812 | 0.72 | — | — | |
| SCHEMBL1573810 | 0.72 | — | — | |
| SCHEMBL18281104 | 0.69 | — | — | |
| SCHEMBL9403034 | 0.69 | — | — | |
| SCHEMBL18281106 | 0.69 | — | — | |
| SCHEMBL9403040 | 0.69 | — | — | |
| SCHEMBL17714593 | 0.69 | — | — | |
| SCHEMBL4213179 | 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 |
|---|---|---|---|---|---|---|---|
| CN-107667085-A | Process for the synthesis of 1, 2, 3, 4-tetrachloro-hexafluoro-butane | 索尔维特殊聚合物意大利有限公司 | 2018-02-06 | — | — | CN | claimed |
| CN-107667085-A | Process for the synthesis of 1, 2, 3, 4-tetrachloro-hexafluoro-butane | 索尔维特殊聚合物意大利有限公司 | 2018-02-06 | — | — | CN | disclosed |