⚠ 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 | |
|---|---|---|---|---|
| Dichlorotetrafluoroethane SCHEMBL29006603 | 0.87 | — | — | |
| SCHEMBL9240808 | 0.87 | — | — | |
| Chloropentafluoroethane SCHEMBL10983880 | 0.84 | — | — | |
| SCHEMBL29006601 | 0.84 | — | — | |
| SCHEMBL1553119 | 0.80 | — | — | |
| Trichloromonofluoromethane SCHEMBL20544125 | 0.78 | TSHR (0.33) | — | |
| Trichloromonofluoromethane SCHEMBL9670411 | 0.78 | — | — | |
| Trichloromonofluoromethane SCHEMBL10604091 | 0.76 | — | — | |
| Dichlorodifluoromethane SCHEMBL7551016 | 0.76 | — | — | |
| SCHEMBL13716379 | 0.74 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111051365-B | Preparation method of strain hardening polypropylene | 埃克森美孚化学专利公司 | 2023-05-23 | — | — | CN | disclosed |