⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28352911 | 1.00 | — | — | |
| SCHEMBL28352909 | 1.00 | — | — | |
| SCHEMBL28728497 | 0.91 | — | — | |
| SCHEMBL28728580 | 0.88 | CA1 (0.39) | — | |
| SCHEMBL28728578 | 0.88 | CA1 (0.39) | — | |
| SCHEMBL10605746 | 0.87 | CA1 (0.47) | — | |
| SCHEMBL28559988 | 0.81 | — | — | |
| SCHEMBL16664836 | 0.80 | — | — | |
| SCHEMBL135186 | 0.80 | — | — | |
| SCHEMBL22283870 | 0.80 | TSHR (0.50) | — |
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-111925345-B | Preparation method of chiral 2-aminomethyltetrahydrofuran | 上海科利生物医药有限公司 | 2023-09-29 | — | — | CN | disclosed |
| CN-111925345-A | Preparation method of chiral 2-aminomethyl tetrahydrofuran | 上海科利生物医药有限公司 | 2020-11-13 | — | — | CN | disclosed |