SCHEMBL3933294

SCHEMBL3933294

O=CC1C=CC=CC1(Br)[N+](=O)[O-]

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL1815629 0.84
SCHEMBL5521713 0.76
SCHEMBL2334647 0.75
SCHEMBL2366613 0.74
SCHEMBL856758 0.73
SCHEMBL20660050 0.73
SCHEMBL4390587 0.70
SCHEMBL5196121 0.69
SCHEMBL28603125 0.68
SCHEMBL9818515 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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105669566-A Preparation method of pharmaceutical intermediate N-arylquinazolinyl-amine compounds 华东师范大学 2016-06-15 CN claimed
CN-105419785-A Subject and object compounded multi-photon polarization laser material based on metal-organic framework and preparation method of subject and object compounded multi-photon polarization laser material UNIV ZHEJIANG 2016-03-23 CN claimed
CN-103880683-A Chemical synthesis method of 3-bromo-2-nitrobenzaldehyde UNIV NANTONG 2014-06-25 CN claimed
CN-110312711-A Heterocyclic compound and its application method as RAS inhibitor 亚瑞克西斯制药公司 2019-10-08 CN disclosed
CN-110117273-A 2H- indazole derivative and its medical application as cell cycle protein dependent kinase (CDK) inhibitor 贝达医药公司 2019-08-13 CN disclosed
CN-105814040-B The condensed 1,4- dihydro two of inhibitor as thermal excited transcryption factor 1 dislikes ene derivative 癌症研究科技有限公司 2019-07-30 CN disclosed
CN-106687454-B 2H-indazole derivatives as Cyclin Dependent Kinase (CDK) inhibitors and their medical use 贝达医药公司 2019-06-21 CN disclosed
CN-109476646-A Dicyclic compound as pest control agent 拜耳作物科学股份公司 2019-03-15 CN disclosed
CN-109096192-A The benzo-aza * of 8- substitutions is as class TOLL receptor modulators 阿雷生物药品公司 2018-12-28 CN disclosed
CN-109096193-A The benzo-aza * of 8- substitutions is as class TOLL receptor modulators 阿雷生物药品公司 2018-12-28 CN disclosed
CN-106397318-B A kind of 10- nitrogen (miscellaneous) anthracene derivant and its preparation method and application 长春海谱润斯科技有限公司 2018-12-25 CN disclosed
EP-2044083-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2009-04-08 EP disclosed
US-20080051384-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. 2008-02-28 US disclosed
WO-2008008907-A2 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO disclosed
WO-2008008912-A1 ANTIVIRAL AGENTS GENELABS TECHNOLOGIES, INC. (US) 2008-01-17 WO disclosed
CN-101103026-A Bicyclic heteroaryl derivatives for treating viruses GENELABS INC (US) 2008-01-09 CN disclosed
EP-1844042-A1 INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2007-10-17 EP disclosed
WO-2007109334-A2 SIP RECEPTOR MODULATING COMPOUNDS AND USE THEREOF EPIX DELAWARE, INC. (US) 2007-09-27 WO disclosed
US-20060211698-A1 Bicyclic heteroaryl derivatives for treating viruses GENELABS, INC. 2006-09-21 US disclosed
WO-2006076529-A1 INDOLE DERIVATIVES FOR TREATING VIRAL INFECTIONS GENELABS TECHNOLOGIES, INC. (US) 2006-07-20 WO disclosed