⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9739314 | 0.72 | HPGD (0.32) | — | |
| SCHEMBL131237 | 0.70 | ALDH1A1 (0.38) | — | |
| SCHEMBL28161237 | 0.69 | ALDH1A1 (0.34) | — | |
| SCHEMBL28161238 | 0.68 | HCAR2 (0.35) | — | |
| SCHEMBL28193410 | 0.67 | TSHR (0.38) | — | |
| SCHEMBL340081 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL27614309 | 0.66 | ATM (0.39) | — | |
| SCHEMBL28007875 | 0.66 | ALDH1A1 (0.34) | — | |
| SCHEMBL28309639 | 0.66 | CYP4F2 (0.38) | — | |
| SCHEMBL8593909 | 0.65 | NAAA (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110892017-B | Fluororubber composition, process for producing the same, and fluororubber crosslinked molded article | NOK株式会社 | 2022-03-01 | — | — | CN | disclosed |