⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27866188 | 0.84 | MAPT (0.30) | — | |
| SCHEMBL2396750 | 0.74 | — | — | |
| SCHEMBL29006138 | 0.73 | — | — | |
| SCHEMBL27834926 | 0.73 | — | — | |
| SCHEMBL21462141 | 0.71 | — | — | |
| SCHEMBL398536 | 0.70 | NPSR1 (0.44) | — | |
| SCHEMBL27521896 | 0.69 | — | — | |
| SCHEMBL27637813 | 0.69 | — | — | |
| SCHEMBL3258421 | 0.67 | NPSR1 (0.43) | — | |
| SCHEMBL28692280 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108069936-A | A kind of synthesis and its application of polyhalo pyrazoles formyl urea derivative | 江苏扬农化工股份有限公司 | 2018-05-25 | — | — | CN | claimed |
| CN-108069936-A | A kind of synthesis and its application of polyhalo pyrazoles formyl urea derivative | 江苏扬农化工股份有限公司 | 2018-05-25 | — | — | CN | disclosed |
| CN-108069936-A | A kind of synthesis and its application of polyhalo pyrazoles formyl urea derivative | 江苏扬农化工股份有限公司 | 2018-05-25 | — | — | CN | disclosed |
| CN-108069936-A | A kind of synthesis and its application of polyhalo pyrazoles formyl urea derivative | 江苏扬农化工股份有限公司 | 2018-05-25 | — | — | CN | disclosed |