SCHEMBL3908898

SCHEMBL3908898

CC1([N+](=O)[O-])C=CC=C([N+](=O)[O-])C1O

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
SCHEMBL9707456 0.81
SCHEMBL5933926 0.79
SCHEMBL29126639 0.79
SCHEMBL6369542 0.77 TP53 (0.30)
SCHEMBL28210336 0.71
SCHEMBL9770591 0.69
SCHEMBL5550677 0.69
SCHEMBL7860948 0.67
SCHEMBL28871100 0.67
SCHEMBL11742503 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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0411604-B1 Method and kit for determination of components KYOWA MEDEX CO LTD (JP) 1995-02-15 EP claimed
US-5246836-A Colorimetric KYOWA MEDEX CO., LTD. (JP) 1993-09-21 US claimed
EP-0411604-A2 Method and kit for determination of components KYOWA MEDEX CO.LTD. (JP) 1991-02-06 EP claimed
US-4973787-A USE OF DINITROCRESOL AS POLYMERIZATION INHIBITOR THE GOODYEAR TIRE & RUBBER COMPANY (US) 1990-11-27 US claimed
US-4416982-A REACTING WITH PHENOLIC COMPOUND OR ANILINE COMPOUND IN THE PRESENCE OF PEROXIDASE KYOWA HAKKO KOGYO CO., LTD. (JP) 1983-11-22 US claimed
CN-108929264-A A kind of preparation method of fluazinam 岳晟 2018-12-04 CN disclosed
US-7585132-B2 Method for remediating a contaminated site Imbrie, James (US) 2009-09-08 US disclosed
US-20070297858-A1 Method for remediating a contaminated site IMBRIE JAMES 2007-12-27 US disclosed
US-20060157667-A1 Method and compositions for controlling release of organic compositions BOARD OF TRUSTEES OF MICHIGAN STATE UNIVERSITY (US) 2006-07-20 US disclosed
CN-1082499-C Mixtures containing monomers and stabilizers BASF AG (DE) 2002-04-10 CN disclosed
US-6143205-A A MIXTRUE COMPRISES A VINYL-CONTAINING MONOMERS, AND A MIXTURE OF PREMATURE POLYMERIZATION INHIBITOR OF MONOMERS DURING PURIFICATION OR DISTILLATION COMPRISING A N-OXYL COMPOUND OF SECONDARY AMINE AND A NITRO COMPOUND BASF AKTIENGESELLSCHAFT (DE) 2000-11-07 US disclosed
CN-1211968-A Mixtures containing monomers and stabilizers BASF AG (DE) 1999-03-24 CN disclosed
EP-0411604-B1 Method and kit for determination of components KYOWA MEDEX CO LTD (JP) 1995-02-15 EP disclosed
US-5246836-A Colorimetric KYOWA MEDEX CO., LTD. (JP) 1993-09-21 US disclosed
EP-0411604-A2 Method and kit for determination of components KYOWA MEDEX CO.LTD. (JP) 1991-02-06 EP disclosed
EP-0345550-A2 High molecular weight arylene sulphide polymers BAYER AG (DE) 1989-12-13 EP disclosed
EP-0054358-B1 METHOD FOR DECOMPOSING HYDROGEN PEROXIDE AND APPLICATION TO THE DETERMINATION OF AN ANALYTE KYOWA HAKKO KOGYO CO., LTD. (JP) 1985-04-17 EP disclosed
US-4416982-A REACTING WITH PHENOLIC COMPOUND OR ANILINE COMPOUND IN THE PRESENCE OF PEROXIDASE KYOWA HAKKO KOGYO CO., LTD. (JP) 1983-11-22 US disclosed