⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15510509 | 0.85 | TP53 (0.30) | — | |
| SCHEMBL28849494 | 0.85 | — | — | |
| SCHEMBL365196 | 0.85 | — | — | |
| Fluoride SCHEMBL15754361 | 0.82 | — | — | |
| SCHEMBL10545764 | 0.73 | — | — | |
| SCHEMBL6689515 | 0.73 | — | — | |
| SCHEMBL16649988 | 0.70 | — | — | |
| SCHEMBL6360894 | 0.69 | — | — | |
| SCHEMBL6903581 | 0.67 | TSHR (0.56) | — | |
| SCHEMBL159953 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110483233-A | The method for preparing 1,1,3,3- tetrachloropropylene | OCCIDENTAL CHEM CO | 2019-11-22 | — | — | CN | disclosed |
| CN-106458798-B | Method for preparing 1,1,3, 3-tetrachloropropene | 西方化学股份有限公司 | 2019-10-08 | — | — | CN | disclosed |
| US-20120053371-A1 | METHOD FOR PRODUCING FLUORINATED ORGANIC COMPOUNDS | HONEYWELL INTERNATIONAL INC. (US) | 2012-03-01 | — | — | US | disclosed |