⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24925064 | 0.91 | — | — | |
| SCHEMBL24925058 | 0.89 | DNM1 (0.32) | — | |
| SCHEMBL17922079 | 0.89 | HSD17B10 (0.32) | — | |
| SCHEMBL20216565 | 0.87 | — | — | |
| SCHEMBL11995915 | 0.87 | — | — | |
| SCHEMBL24924896 | 0.84 | ADRB2 (0.35) | — | |
| SCHEMBL798901 | 0.83 | — | — | |
| SCHEMBL12061805 | 0.81 | — | — | |
| SCHEMBL12670003 | 0.81 | — | — | |
| SCHEMBL14223689 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023007465-A1 | FLUORINATED ETHERS, THERMAL MANAGEMENT FLUIDS, AND METHODS AND APPARATUSES USING THEM | CASTROL LIMITED (GB) | 2023-02-02 | — | — | WO | disclosed |