⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1509371 | 0.83 | — | — | |
| SCHEMBL11231190 | 0.83 | — | — | |
| SCHEMBL20436103 | 0.77 | — | — | |
| SCHEMBL10458185 | 0.72 | — | — | |
| SCHEMBL10014492 | 0.72 | — | — | |
| SCHEMBL10596599 | 0.72 | — | — | |
| SCHEMBL17069349 | 0.72 | — | — | |
| SCHEMBL1562 | 0.72 | — | — | |
| SCHEMBL5316447 | 0.68 | — | — | |
| SCHEMBL6101097 | 0.68 | — | — |
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 596 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109485644-A | A kind of substituted benzo isothiazole compound and preparation method thereof and purposes | 山东省联合农药工业有限公司 | 2019-03-19 | — | — | CN | claimed |
| CN-103833915-B | Molecularly imprinted polymer nano particle suitable for pure biological sample and preparation method thereof | 南开大学 | 2018-04-13 | — | — | CN | claimed |
| CN-107417682-A | A kind of substituted benzo isothiazole compound and purposes | 山东省联合农药工业有限公司 | 2017-12-01 | — | — | CN | claimed |
| CN-106317335-A | Molecularly imprinted polymer sensing material suitable for biological samples and preparation method of sensing material | 南开大学 | 2017-01-11 | — | — | CN | claimed |
| CN-104136021-A | Use of substituted diphenylamine compounds in preparing anti-tumour drugs | SINOCHEM CORP | 2014-11-05 | — | — | CN | claimed |
| CN-103833915-A | Molecular imprinting polymer nanoparticles for pure biological sample, and preparation method thereof | UNIV NANKAI | 2014-06-04 | — | — | CN | claimed |
| CN-103301096-A | Application of substituted diphenylamine compound to preparation of antitumor drugs | SINOCHEM CORP | 2013-09-18 | — | — | CN | claimed |
| CN-102762530-A | Substituted diphenylamine compounds, preparation method and use thereof | SINOCHEM CORP | 2012-10-31 | — | — | CN | claimed |
| CN-101265224-B | Method for preparing 4-trifluoromethylmercaptoaniline | JINTAN LINGYUN CHEMICAL FACTORY | 2010-12-08 | — | — | CN | claimed |
| CN-101323584-A | Oxime ether aryl pyrrole compounds having insecticidal, acaricidal and antifungal bioactivity | HUNAN RES INST OF CHEMICAL IND (CN) | 2008-12-17 | — | — | CN | claimed |
| CN-1444564-A | Biphenyl carboxamides | BAYER CORPS SCIENCE AG (DE) | 2003-09-24 | — | — | CN | claimed |
| CN-1316990-A | Methoximinophenylacetic acid amides | BAYER AG (DE) | 2001-10-10 | — | — | CN | claimed |
| CN-1041922-C | Heterocyclic compounds | ZENECA LTD (GB) | 1999-02-03 | — | — | CN | claimed |
| CN-1039415-C | Heterocyclic compounds | ZENECA LTD (GB) | 1998-08-05 | — | — | CN | claimed |
| CN-1036304-C | Phenyltriazole derivatives and insecticides | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1997-11-05 | — | — | CN | claimed |
| CN-1098718-A | Heterogeneous ring compound | ZENECA LTD (GB) | 1995-02-15 | — | — | CN | claimed |
| CN-1095379-A | Condensed heterocyclic derivates and weedicide | KUMIAI CHEMICAL INDUSTRY CO (JP) | 1994-11-23 | — | — | CN | claimed |
| CN-1094400-A | Heterogeneous ring compound | ZENECA LTD (GB) | 1994-11-02 | — | — | CN | claimed |
| CN-1046526-A | New compound and preparation method thereof | ICI PLC (GB) | 1990-10-31 | — | — | CN | claimed |
| CN-87103967-A | 1,2,3,6-tetrahydrochysene-5-nitro-pyrimidine derivatives | — | 1987-12-16 | — | — | CN | claimed |