SCHEMBL30424972

SCHEMBL30424972

Clc1cc(-c2cc(Cl)c(Cl)c(Cl)c2Cl)cc(Cl)c1Cl

nearest known ligand 0.67

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
AHR P35869 11/20 0.67
CYP3A4 P08684 3/20 0.53
CYP1B1 Q16678 1/20 0.44
ALDH1A1 P00352 1/20 0.43
HPGD P15428 4/20 0.42
HSD17B10 Q99714 4/20 0.42
TSHR P16473 3/20 0.42
HSP90AA1 P07900 1/20 0.42
CRHBP P24387 1/20 0.39
CRHR2 Q13324 1/20 0.39
MAPK1 P28482 2/20 0.36
TTR P02766 1/20 0.33
CASP1 P29466 1/20 0.33

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
SCHEMBL2905963 1.00 AHR (0.67) AHRCYP3A4CYP1B1ALDH1A1HPGD
SCHEMBL4451855 0.84 AHR (0.64) AHRCYP3A4CYP1B1ALDH1A1HPGD
SCHEMBL30621950 0.84 AHR (0.64) AHRCYP3A4CYP1B1ALDH1A1HPGD
SCHEMBL2230314 0.82 CYP3A4 (0.67) AHRCYP3A4ALDH1A1HPGDHSD17B10
SCHEMBL30034845 0.82 CYP3A4 (0.67) AHRCYP3A4ALDH1A1HPGDHSD17B10
SCHEMBL2279549 0.80 AHR (1.00) AHRCYP3A4CYP1B1
SCHEMBL29389344 0.80 AHR (1.00) AHRCYP3A4CYP1B1
SCHEMBL2907676 0.79 AHR (1.00) AHRCYP3A4CYP1B1ALDH1A1HPGD
SCHEMBL2281805 0.78 AHR (1.00) AHRCYP3A4CYP1B1ALDH1A1HPGD
SCHEMBL29944597 0.78 AHR (1.00) AHRCYP3A4CYP1B1ALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117571845-A Method for rapidly and efficiently detecting organic chlorine and polychlorinated biphenyl in soil simultaneously 济南市环境研究院(济南市黄河流域生态保护促进中心) 2024-02-20 CN claimed
CN-116893235-A Method and kit for determining polychlorinated biphenyl and multi-class brominated flame retardant residues in traditional Chinese medicine 江苏省食品药品监督检验研究院(江苏省食品质量安全监控中心) 2023-10-17 CN claimed
CN-113495108-B Method for simultaneously detecting 63 persistent organic pollutants in soil 生态环境部华南环境科学研究所 2023-07-28 CN claimed
CN-114014934-B Polychlorinated biphenyl monoclonal antibody and application thereof 江苏省农业科学院 2023-05-05 CN claimed
CN-117147725-B Method for measuring polychlorinated biphenyl content and total amount in sample by adopting quantitative ion abundance compensation mode 四川省生态环境监测总站 2024-04-26 CN disclosed
CN-117571845-A Method for rapidly and efficiently detecting organic chlorine and polychlorinated biphenyl in soil simultaneously 济南市环境研究院(济南市黄河流域生态保护促进中心) 2024-02-20 CN disclosed
CN-117323696-A Purifying and separating column and purifying and separating method for dioxin and polychlorinated biphenyl 浙江省疾病预防控制中心 2024-01-02 CN disclosed
CN-117147725-A Method for measuring polychlorinated biphenyl content and total amount in sample by adopting quantitative ion abundance compensation mode 四川省生态环境监测总站 2023-12-01 CN disclosed
US-20230330725-A1 VOLATILIZATION AND OXIDATION OF ORGANIC WASTE NATIONAL BANK OF CANADA (CA) 2023-10-19 US disclosed
CN-116893235-A Method and kit for determining polychlorinated biphenyl and multi-class brominated flame retardant residues in traditional Chinese medicine 江苏省食品药品监督检验研究院(江苏省食品质量安全监控中心) 2023-10-17 CN disclosed
CN-113535678-B Construction method of surface water environment priority pollutant list 中国科学院南京地理与湖泊研究所 2023-08-11 CN disclosed
CN-113495108-B Method for simultaneously detecting 63 persistent organic pollutants in soil 生态环境部华南环境科学研究所 2023-07-28 CN disclosed
CN-114014934-B Polychlorinated biphenyl monoclonal antibody and application thereof 江苏省农业科学院 2023-05-05 CN disclosed