⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11767243 | 0.74 | — | — | |
| SCHEMBL23961543 | 0.71 | — | — | |
| SCHEMBL30875849 | 0.71 | — | — | |
| SCHEMBL23961563 | 0.71 | — | — | |
| SCHEMBL23961443 | 0.69 | — | — | |
| SCHEMBL23961538 | 0.64 | — | — | |
| SCHEMBL3878748 | 0.63 | — | — | |
| SCHEMBL9504150 | 0.62 | — | — | |
| SCHEMBL23961465 | 0.62 | — | — | |
| SCHEMBL23961560 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-5170689-A | — | — | None | — | — | JP | disclosed |
| JP-H05170689-A | AROMATIC DERIVATIVE CONTAINING PERFLUORO-OXA-ALKYL GROUP AND ITS PRODUCTION | NIPPON OIL & FATS CO LTD | 1993-07-09 | — | — | JP | disclosed |