⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28057245 | 0.92 | — | — | |
| SCHEMBL7119961 | 0.82 | — | — | |
| SCHEMBL6436551 | 0.76 | — | — | |
| SCHEMBL10934385 | 0.76 | — | — | |
| SCHEMBL27954244 | 0.74 | MEN1 (0.55) | — | |
| SCHEMBL27422918 | 0.74 | — | — | |
| SCHEMBL4018798 | 0.72 | — | — | |
| SCHEMBL7914825 | 0.72 | — | — | |
| SCHEMBL11801598 | 0.72 | — | — | |
| SCHEMBL891393 | 0.72 | DNM1 (0.48) | — |
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-103508856-A | Making method of dyhydroxy ether compound | SUMITOMO CHEMICAL CO | 2014-01-15 | — | — | CN | disclosed |