⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2936008 | 0.90 | — | — | |
| SCHEMBL13858924 | 0.78 | — | — | |
| SCHEMBL12962922 | 0.75 | — | — | |
| SCHEMBL17994210 | 0.73 | — | — | |
| Formic Acid SCHEMBL25243578 | 0.67 | — | — | |
| Formic Acid SCHEMBL19463645 | 0.62 | — | — | |
| Formic Acid SCHEMBL19463847 | 0.62 | — | — | |
| Formic Acid SCHEMBL19463710 | 0.62 | — | — | |
| Formic Acid SCHEMBL19464091 | 0.62 | — | — | |
| Formic Acid SCHEMBL28252763 | 0.62 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108299214-B | A kind of Selective Separation or the method for recycling amino-compound | 华中科技大学 | 2019-11-12 | — | — | CN | claimed |
| CN-108299214-B | A kind of Selective Separation or the method for recycling amino-compound | 华中科技大学 | 2019-11-12 | — | — | CN | disclosed |
| CN-108299214-A | A kind of Selective Separation or the method for recycling amino-compound | 华中科技大学 | 2018-07-20 | — | — | CN | disclosed |