⚠ 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 | |
|---|---|---|---|---|
| Propene SCHEMBL10948380 | 0.86 | — | — | |
| Ethylenediamine SCHEMBL29102305 | 0.86 | — | — | |
| SCHEMBL5834763 | 0.84 | — | — | |
| Thiazolidinedione SCHEMBL4406401 | 0.72 | GSK3A (0.48) | — | |
| SCHEMBL1325231 | 0.69 | — | — | |
| SCHEMBL6425142 | 0.67 | — | — | |
| SCHEMBL8728473 | 0.65 | — | — | |
| SCHEMBL1521685 | 0.65 | — | — | |
| SCHEMBL10564784 | 0.65 | — | — | |
| SCHEMBL22265064 | 0.65 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1296373-C | Bridge-linked high steric-hindrance amino-methano-phenol organic zinc compounds and process for preparing same | UNIV SHANXI (CN) | 2007-01-24 | — | — | CN | disclosed |
| CN-1259323-C | High steric-hindrance amino-methano-phenol organic zinc compounds and process for preparing same | UNIV SHANXI (CN) | 2006-06-14 | — | — | CN | disclosed |