SCHEMBL9097204

SCHEMBL9097204

Brc1cc2cc3ccccc3cc2cc1Br

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 5/20 0.50
ALDH1A1 P00352 6/20 0.48
HSD17B10 Q99714 4/20 0.48
HIF1A Q16665 3/20 0.48
TDP1 Q9NUW8 3/20 0.48
CYP3A4 P08684 2/20 0.48
CASP1 P29466 2/20 0.48
CASP7 P55210 2/20 0.48
ALOX15 P16050 1/20 0.48
HBB P68871 1/20 0.48
ALOX12 P18054 1/20 0.41
HPGD P15428 2/20 0.41
GLA P06280 1/20 0.41
MAPT P10636 1/20 0.41
ACHE P22303 1/20 0.41
NCEH1 Q6PIU2 1/20 0.39
NQO2 P16083 1/20 0.39
CYP1B1 Q16678 1/20 0.39
CYP1A2 P05177 2/20 0.38
CA1 P00915 1/20 0.38

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
SCHEMBL3465676 1.00 CYP2A6 (0.50) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
SCHEMBL5008807 1.00 CYP2A6 (0.50) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
SCHEMBL5010983 1.00 CYP2A6 (0.50) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
SCHEMBL3259247 1.00 CYP2A6 (0.50) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
SCHEMBL9095175 0.94 CYP2A6 (0.55) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
SCHEMBL29374851 0.94 CYP2A6 (0.55) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
Benz(B)Anthracene SCHEMBL7947 0.83 ALDH1A1 (0.61) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
SCHEMBL25181 0.83 ALDH1A1 (0.61) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
SCHEMBL22634171 0.83 ALDH1A1 (0.61) CYP2A6ALDH1A1HSD17B10HIF1ATDP1
Benz(B)Anthracene SCHEMBL22352910 0.83 ALDH1A1 (0.61) CYP2A6ALDH1A1HSD17B10HIF1ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025100709-A1 ORGANIC LIGHT-EMITTING COMPOUND, AND ORGANIC ELECTROLUMINESCENT DEVICE COMPRISING SAME 솔루스첨단소재 주식회사 2025-05-15 WO disclosed
CN-106749082-B A kind of Anthraquinones electroluminescent organic material and its preparation method and application 中节能万润股份有限公司 2019-03-15 CN disclosed
CN-109456297-A A kind of luminous organic material and its preparation method and the organic electroluminescence device containing the material 吉林奥来德光电材料股份有限公司 2019-03-12 CN disclosed
CN-109384726-A A kind of organic luminescent compounds and preparation method thereof and organic electroluminescence device 吉林奥来德光电材料股份有限公司 2019-02-26 CN disclosed
CN-109369660-A Luminous organic material and its preparation method and organic electroluminescence device containing the material 吉林奥来德光电材料股份有限公司 2019-02-22 CN disclosed
CN-107602479-A One kind connection anthracene compound and its synthetic method and organic luminescent device 长春海谱润斯科技有限公司 2018-01-19 CN disclosed
CN-107602336-A A kind of anthracene derivative and its synthetic method and organic luminescent device 长春海谱润斯科技有限公司 2018-01-19 CN disclosed
CN-106749082-A A kind of Anthraquinones electroluminescent organic material and its preparation method and application 中节能万润股份有限公司 2017-05-31 CN disclosed
US-5527805-A DNA-CLEAVING, CYTOTOXIC AND ANTI-TUMOR COMPOUNDS THE SCRIPPS RESEARCH INSTITUTE (US) 1996-06-18 US disclosed
EP-0594624-A1 DYNEMICIN ANALOGS: SYNTHESES, METHODS OF PREPARATION AND USE SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1994-05-04 EP disclosed
EP-0594624-A4 DYNEMICIN ANALOGS: SYNTHESES, METHODS OF PREPARATION AND USE. SCRIPPS CLINIC RES (US) 1994-02-21 EP disclosed
US-5281710-A Antibiotics or antitumor agents THE SCRIPPS RESEARCH INSTITUTE (US) 1994-01-25 US disclosed
US-5276159-A Antitumor THE SCRIPPS RESEARCH INSTITUTE (US) 1994-01-04 US disclosed
WO-1992002522-A1 DYNEMICIN ANALOGS: SYNTHESES, METHODS OF PREPARATION AND USE SCRIPPS CLINIC AND RESEARCH FOUNDATION (US) 1992-02-20 WO disclosed
EP-0076639-B1 PRODUCTION OF 11,11,12,12-TETRACYANO-9,10-ANTHRAQUINODIMETHANE AND DERIVATIVES THEREOF MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1985-12-18 EP disclosed
US-4478753-A HALOMETHYLATION, FORMYLATION, DECYANATION, AND DEHYDROGENATION MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1984-10-23 US disclosed
EP-0076639-A1 Production of 11,11,12,12-Tetracyano-9,10-anthraquinodimethane and derivatives thereof MATSUSHITA ELECTRIC INDUSTRIAL CO., LTD. (JP) 1983-04-13 EP disclosed
US-4135045-A PROCESS FOR POLYMERIZATION OF OLEFINS AND CATALYST COMPOSITION THEREFOR MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1979-01-16 US disclosed
US-4048415-A TITANIUM-ALUMINUM COORDINATION CATALYSTS MITSUI PETROCHEMICAL INDUSTRIES LTD. (JA) 1977-09-13 US disclosed