SCHEMBL6994886

SCHEMBL6994886

ClC1(Cl)Oc2ccccc2OC1(Cl)Cl

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.38
LMNA P02545 4/20 0.36
HTT P42858 2/20 0.36
ABCG2 Q9UNQ0 1/20 0.36
ITGB2 P05107 1/20 0.36
ICAM1 P05362 1/20 0.36
ITGAL P20701 1/20 0.36
AHR P35869 3/20 0.36
CRHBP P24387 2/20 0.32
CRHR2 Q13324 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL9273413 0.82 LMNA (0.32) ALOX5LMNAHTTAHR
SCHEMBL10602956 0.82 HTT (0.39) ALOX5LMNAHTTAHRALDH1A1
SCHEMBL1003323 0.81 ALOX5 (0.38) ALOX5LMNAHTTABCG2ITGB2
SCHEMBL29973180 0.81 ALOX5 (0.38) ALOX5LMNAHTTABCG2ITGB2
SCHEMBL6990050 0.77 ALOX5 (0.35) ALOX5LMNAHTTABCG2ITGB2
SCHEMBL8764608 0.77 ALOX5 (0.35) ALOX5LMNAHTTABCG2ITGB2
SCHEMBL10965410 0.75 SIGMAR1 (0.45) ABCG2ITGB2ICAM1ITGALMAOA
SCHEMBL9289415 0.73 ALOX5 (0.41) ALOX5LMNAHTTABCG2ITGB2
SCHEMBL30185992 0.73 ALOX5 (0.41) ALOX5LMNAHTTABCG2ITGB2
SCHEMBL9494642 0.73

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6090954-A 2,3-DICHLORO-2,3-DIFLUORO-(1,4)-BENZODIOXANE, 2,3-DICHLORO-2,3-DIFLUORO-6,7-DINITRO-(1,4)-BENZODIOXANE, AND 6,7-DIAMINO-2,3-DICHLORO-2,3-DIFLUORO-(1,4)-BENZODIOXANE, AND PREPARATION; PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-07-18 US claimed
EP-0758334-A1 SUBSTITUTED (1,4)DIOXINO(2,3-F)BENZOIMIDAZOLE DERIVATIVES AND THEIR USE IN PEST CONTROL BAYER AG (DE) 1997-02-19 EP claimed
WO-1995029918-A1 SUBSTITUTED (1,4)DIOXINO(2,3-F)BENZOIMIDAZOLE DERIVATIVES AND THEIR USE IN PEST CONTROL BAYER AKTIENGESELLSCHAFT (DE) 1995-11-09 WO claimed
JP-6329574-A None JP disclosed
CN-117447402-A Aromatic hydrocarbon receptor modulator compound, and preparation method and application thereof 德明药泰生物技术(深圳)有限公司 2024-01-26 CN disclosed
CN-117003730-A Substituted pyrimidine hydrazide compound and preparation method and application thereof 德明药泰生物技术(深圳)有限公司 2023-11-07 CN disclosed
EP-0758334-B1 SUBSTITUTED (1,4)DIOXINO(2,3-F)BENZOIMIDAZOLE DERIVATIVES AND THEIR USE IN PEST CONTROL BAYER CROPSCIENCE AG (DE) 2003-02-05 EP disclosed
US-6090954-A 2,3-DICHLORO-2,3-DIFLUORO-(1,4)-BENZODIOXANE, 2,3-DICHLORO-2,3-DIFLUORO-6,7-DINITRO-(1,4)-BENZODIOXANE, AND 6,7-DIAMINO-2,3-DICHLORO-2,3-DIFLUORO-(1,4)-BENZODIOXANE, AND PREPARATION; PESTICIDES BAYER AKTIENGESELLSCHAFT (DE) 2000-07-18 US disclosed
CN-1049894-C Substd. (1,4)-dioxino[2,3-F] benzoimidazole derivs. and their use in pest control BAYER AG (DE) 2000-03-01 CN disclosed
US-5990316-A Substituted (1,4)dioxino(2,3-F) 6,7-Dichloro-6,7-difluoro-2-trichloromethyl-[1,4]-dioxino-[2,3-f]-benzim idazole and their use in pest control BAYER AKTIENGESELLSCHAFT (DE) 1999-11-23 US disclosed
US-5792873-A PESTICIDES SYNTHESIS FROM NEW CHEMICAL INTERMEDIATES BAYER AKTIENGESELLSCHAFT (DE) 1998-08-11 US disclosed
US-5648316-A FUNGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1997-07-15 US disclosed
CN-1147255-A Substituted- [1, 4] -dioxino- [2, 3-f ] -benzimidazole derivatives and their use in pest control BAYER AG (DE) 1997-04-09 CN disclosed
EP-0758334-A1 SUBSTITUTED (1,4)DIOXINO(2,3-F)BENZOIMIDAZOLE DERIVATIVES AND THEIR USE IN PEST CONTROL BAYER AG (DE) 1997-02-19 EP disclosed
WO-1995029918-A1 SUBSTITUTED (1,4)DIOXINO(2,3-F)BENZOIMIDAZOLE DERIVATIVES AND THEIR USE IN PEST CONTROL BAYER AKTIENGESELLSCHAFT (DE) 1995-11-09 WO disclosed
US-5463088-A Process for preparing perfluoroalkoxy (alkylthio) benzenes BAYER AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
JP-H06329574-A PREPARATION OF PERFLUOROALKOXY(ALKYLTHIO) BENZENES BAYER AG 1994-11-29 JP disclosed
EP-0156195-B1 METHOD FOR THE PREPARATION OF 2,2,3,3-TETRACHLORO-2,3-DIHYDRO-1,4-BENZODIOXINES, AND THE COMPOUND 6-ISOCYANATO-2,2,3,3-TETRACHLORO-2,3-DIHYDRO-1,4-BENZODIOXINE BAYER AG (DE) 1988-05-11 EP disclosed
EP-0156195-A1 Method for the preparation of 2,2,3,3-tetrachloro-2,3-dihydro-1,4-benzodioxines, and the compound 6-isocyanato-2,2,3,3-tetrachloro-2,3-dihydro-1,4-benzodioxine BAYER AG (DE) 1985-10-02 EP disclosed
US-3749677-A CHEMILUMINESCENT REACTION OF SUBSTITUTED 2,2,3,3-TETRACHLORO-1,4-BENZODIOXANE AMERICAN CYANAMID CO 1973-07-31 US disclosed