⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL283741 | 0.76 | — | — | |
| SCHEMBL4610913 | 0.72 | — | — | |
| SCHEMBL6934362 | 0.72 | — | — | |
| SCHEMBL15683 | 0.62 | — | — | |
| SCHEMBL52429 | 0.62 | — | — | |
| SCHEMBL746597 | 0.61 | — | — | |
| SCHEMBL17302919 | 0.59 | — | — | |
| SCHEMBL22622757 | 0.59 | — | — | |
| SCHEMBL21311002 | 0.59 | — | — | |
| SCHEMBL13717512 | 0.59 | — | — |
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-105349191-B | A kind of anti-freezing agent compositionss and preparation method thereof and purposes | 中国民用航空总局第二研究所 | 2017-03-29 | — | — | CN | disclosed |
| WO-1996013558-A1 | UNSATURATED BINDER COMPOSITION | PERSTORP AB (SE) | 1996-05-09 | — | — | WO | disclosed |
| WO-1994000539-A1 | THE USE OF 1,3-DIOXANES IN LUBRICANT AND RELEASE AGENTS | PERSTORP AB (SE) | 1994-01-06 | — | — | WO | disclosed |