⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9691148 | 0.86 | — | — | |
| SCHEMBL375225 | 0.73 | — | — | |
| SCHEMBL3412310 | 0.69 | — | — | |
| SCHEMBL3108368 | 0.69 | — | — | |
| SCHEMBL8616401 | 0.69 | — | — | |
| SCHEMBL8976825 | 0.69 | — | — | |
| SCHEMBL8892978 | 0.67 | — | — | |
| SCHEMBL6017537 | 0.67 | — | — | |
| SCHEMBL16372512 | 0.65 | — | — | |
| SCHEMBL14133889 | 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-5684111-A | CATALYTIC POLYMERIZATION FORMING POLYSILOXANES, POLYSILAZANES AND POLYTHIOSILOXANES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-11-04 | — | — | US | disclosed |
| US-5250709-A | Dioxolane-containing fluoroepoxides | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-10-05 | — | — | US | disclosed |
| US-5198556-A | Dioxolane-containing fluoroepoxides | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1993-03-30 | — | — | US | disclosed |