⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31590855 | 0.75 | — | — | |
| SCHEMBL10458783 | 0.73 | — | — | |
| SCHEMBL6139339 | 0.72 | ALDH1A1 (0.32) | — | |
| Ether SCHEMBL17313446 | 0.70 | SMN1; SMN2 (0.30) | — | |
| SCHEMBL3058860 | 0.68 | SIRT2 (0.32) | — | |
| SCHEMBL11507214 | 0.68 | — | — | |
| SCHEMBL4359742 | 0.67 | — | — | |
| SCHEMBL5682511 | 0.66 | — | — | |
| SCHEMBL10409071 | 0.66 | — | — | |
| SCHEMBL8850888 | 0.66 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20090143523-A1 | Cycloolefin additon polymer, composite material and molded article thereof, and optical material | ZEON CORPORATION (JP) | 2009-06-04 | — | — | US | disclosed |