⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26453425 | 0.84 | — | — | |
| SCHEMBL1114317 | 0.82 | — | — | |
| SCHEMBL30283062 | 0.82 | — | — | |
| SCHEMBL28421588 | 0.76 | — | — | |
| SCHEMBL3609113 | 0.71 | — | — | |
| SCHEMBL13167846 | 0.67 | — | — | |
| SCHEMBL2305380 | 0.66 | KDM4E (0.35) | — | |
| SCHEMBL2305382 | 0.66 | KDM4E (0.35) | — | |
| SCHEMBL4267933 | 0.64 | TSHR (0.67) | — | |
| SCHEMBL4213559 | 0.63 | TTR (0.33) | — |
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-110627752-B | Preparation method of 3-aminomethyl tetrahydrofuran | 新发药业有限公司 | 2021-08-17 | — | — | CN | disclosed |
| CN-110627752-A | Preparation method of 3-aminomethyl tetrahydrofuran | 新发药业有限公司 | 2019-12-31 | — | — | CN | disclosed |