⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3620813 | 0.75 | — | — | |
| SCHEMBL3622127 | 0.72 | — | — | |
| SCHEMBL3922845 | 0.72 | — | — | |
| SCHEMBL5666492 | 0.72 | — | — | |
| SCHEMBL6521836 | 0.67 | — | — | |
| SCHEMBL27504039 | 0.64 | — | — | |
| Formaldehyde SCHEMBL10893612 | 0.64 | — | — | |
| SCHEMBL13419273 | 0.64 | — | — | |
| Ethylene SCHEMBL2598796 | 0.64 | — | — | |
| SCHEMBL1727833 | 0.61 | — | — |
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-105646359-B | The more sulfuryl amine derivatives of arylpyrazole and its Ultrasonic Radiation synthetic method and application | 中南民族大学 | 2018-09-25 | — | — | CN | disclosed |