⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20284085 | 0.82 | — | — | |
| SCHEMBL14690014 | 0.77 | — | — | |
| SCHEMBL17867619 | 0.71 | — | — | |
| SCHEMBL11501565 | 0.71 | MEN1 (0.32) | — | |
| SCHEMBL18598207 | 0.71 | — | — | |
| SCHEMBL9563148 | 0.71 | — | — | |
| SCHEMBL9750801 | 0.69 | — | — | |
| SCHEMBL10625179 | 0.68 | — | — | |
| SCHEMBL25301186 | 0.68 | — | — | |
| SCHEMBL9563153 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6054626-A | REACTING AN ETHER COMPOUND IN VAPOR PHASE WITH SOLID TRASITION METAL FLUORIDE FLUORINATING AGENT SELECTED FROM COBALT TRIFLUORIDE, SILVER DIFLUORIDE, CERIUM TETRAFLUORIDE, POTASSIUM TETRAFLUOROCOBALTATE, POTASSIUM HEXAFLUORONICKELATE | RHODIA LIMITED (GB) | 2000-04-25 | — | — | US | disclosed |
| CN-1006386-B | PROCESS FOR PRODUCTION OF VINYL CHLORIDE POLYMER | SHINETSU CHEM IND CO (JP) | 1990-01-10 | — | — | CN | disclosed |
| CN-85107531-A | Process for producing vinyl chloride polymer | — | 1987-01-21 | — | — | CN | disclosed |