⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6110098 | 0.79 | TRPA1 (0.31) | — | |
| SCHEMBL10636574 | 0.72 | — | — | |
| SCHEMBL9654231 | 0.72 | — | — | |
| SCHEMBL4239375 | 0.69 | TRPA1 (0.47) | — | |
| SCHEMBL8825864 | 0.67 | — | — | |
| SCHEMBL1977172 | 0.67 | — | — | |
| SCHEMBL15059046 | 0.67 | — | — | |
| SCHEMBL949935 | 0.67 | — | — | |
| SCHEMBL899543 | 0.67 | — | — | |
| SCHEMBL88154 | 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 105 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102245029-A | Herbicidal compositions containing benzoylpyrazole compounds | ISHIHARA SANGYO KAISHA | 2011-11-16 | — | — | CN | claimed |
| CN-101742905-A | Herbicidal composition | ISHIHARA SANGYO KAISHA | 2010-06-16 | — | — | CN | claimed |
| CN-101595107-A | Can improve that P53 is active substituted piperidine and uses thereof | SCHERING CORP ALBANY MOLECULAR (US) | 2009-12-02 | — | — | CN | claimed |
| CN-101331119-A | Benzoylpyrazole compounds and herbicides containing them | ISHIHARA SANGYO KAISHA (JP) | 2008-12-24 | — | — | CN | claimed |
| US-20080275037-A1 | 2-Cyanophenyl fused heterocyclic compounds, and compositions and uses thereof | EVOTEC AG (DE) | 2008-11-06 | — | — | US | claimed |
| CN-100344623-C | Acrylic esters compound and use thereof | MITSUI CHEMCIALS INC (JP) | 2007-10-24 | — | — | CN | claimed |
| US-7045522-B2 | 8-Azabicyclo[3.2.1]oct-2-ene and -octane derivatives technical field | NEUROSEARCH A/S (DK) | 2006-05-16 | — | — | US | claimed |
| CN-1249050-C | Acrylate compounds and use | MITSUI CHEMICALS INC (JP) | 2006-04-05 | — | — | CN | claimed |
| US-20040116703-A1 | 8-Azabicyclo[3.2.1]oct-2-ene and -octane derivatives technical field | NEUROSEARCH A/S | 2004-06-17 | — | — | US | claimed |
| EP-1382605-A2 | 8-azabicyclo(3.2.1)oct-2-ene derivatives and their use as nAChR ligands | NEUROSEARCH A/S (DK) | 2004-01-21 | — | — | EP | claimed |
| US-6680328-B2 | CHOLINERGIC LIGANDS OF NICOTINIC ACETYL CHOLINE RECEPTORS FOR TREATMENT OF CENTRAL NERVOUS SYSTEM DISORDERS, SMOOTH MUSCLE CONTRACTION DISORDERS, ENDOCRINE DISEASES/DISORDERS, NEURODEGENERATION, INFLAMMATION, PAIN, AND DRUG WITHDRAWAL | NEUROSEARCH A/S (DK) | 2004-01-20 | — | — | US | claimed |
| US-20020035122-A1 | 8-azabicyclo[3.2.1]oct-2-ene and -octane derivatives | ANIONA APS (DK) | 2002-03-21 | — | — | US | claimed |
| CN-1326456-A | 8-azabicyclo [3,.2.1] oct-2-ene and-octane derivatives | NEUROSEARCH AS (DK) | 2001-12-12 | — | — | CN | claimed |
| EP-1133494-A1 | 8-AZABICYCLO 3.2.1]OCT-2-ENE AND -OCTANE DERIVATIVES | NEUROSEARCH A/S (DK) | 2001-09-19 | — | — | EP | claimed |
| WO-2000032600-A1 | 8-AZABICYCLO[3.2.1]OCT-2-ENE AND -OCTANE DERIVATIVES | NEUROSEARCH A/S (DK) | 2000-06-08 | — | — | WO | claimed |
| CN-1049846-A | Glutarimide with weeding activity | ROHM & HAAS (US) | 1991-03-13 | — | — | CN | claimed |
| US-4486422-A | SYSTEMIC | THE DOW CHEMICAL COMPANY (US) | 1984-12-04 | — | — | US | claimed |
| US-4486421-A | SYSTEMIC | THE DOW CHEMICAL COMPANY (US) | 1984-12-04 | — | — | US | claimed |
| CN-101742905-B | Herbicidal composition | Ishihara Sangyo Kabushiki Kaisha Ltd. (JP) | 2016-06-01 | — | — | CN | disclosed |
| US-4486422-A | SYSTEMIC | THE DOW CHEMICAL COMPANY (US) | 1984-12-04 | — | — | US | disclosed |