⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6593656 | 0.84 | — | — | |
| SCHEMBL746777 | 0.84 | — | — | |
| SCHEMBL80520 | 0.83 | KIF11 (0.31) | — | |
| SCHEMBL49983 | 0.83 | KIF11 (0.31) | — | |
| SCHEMBL9325480 | 0.81 | — | — | |
| SCHEMBL9030688 | 0.79 | — | — | |
| SCHEMBL1008473 | 0.79 | — | — | |
| SCHEMBL9528791 | 0.79 | — | — | |
| SCHEMBL15271374 | 0.79 | — | — | |
| SCHEMBL7460444 | 0.79 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9862691-B2 | Cyclic triazo and diazo sodium channel blockers | UNIVERSITY OF GREENWICH (GB) | 2018-01-09 | — | — | US | claimed |
| US-20160311784-A1 | CYCLIC TRIAZO AND DIAZO SODIUM CHANNEL BLOCKERS | UNIVERSITY OF GREENWICH (GB) | 2016-10-27 | — | — | US | claimed |
| CN-108794461-B | Fluorine-containing phenyl oxadiazole pyrazole insecticidal bactericide | 青岛科技大学 | 2021-03-09 | — | — | CN | disclosed |
| CN-108794462-B | Oxadiazole insecticidal bactericide containing fluorine cyanimine thiazolidine substituent | 青岛科技大学 | 2021-02-19 | — | — | CN | disclosed |
| CN-104379574-B | For suppressing the heterocyclic carbamate derivatives of the activity of ABL1, ABL2 and BCR ABL1 | 诺华股份有限公司 | 2017-03-01 | — | — | CN | disclosed |
| EP-0320733-B1 | 2-TERT.-BUTYL-5-ISOXAZOLYL METHYLTHIO-3(2H)-PYRIDAZIN-3-ONE DERIVATIVES | BASF Aktiengesellschaft (DE) | 1993-03-03 | — | — | EP | disclosed |
| US-4929617-A | INSECTICIDES, MITICIDES | BASF AKTIENGESELLSCHAFT (DE) | 1990-05-29 | — | — | US | disclosed |
| EP-0351589-A2 | 3(2H)-Pyridazinone derivatives for controlling snails | BASF Aktiengesellschaft (DE) | 1990-01-24 | — | — | EP | disclosed |