SCHEMBL4449569

SCHEMBL4449569

Clc1ccc(-c2c(Cl)cc(Cl)c(Cl)c2Cl)c(Cl)c1Cl

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AHR P35869 10/20 0.58
CYP3A4 P08684 2/20 0.46
ALDH1A1 P00352 1/20 0.38
MAPK1 P28482 2/20 0.37
HPGD P15428 2/20 0.37
TSHR P16473 2/20 0.37
HSD17B10 Q99714 2/20 0.37
TDP1 Q9NUW8 1/20 0.35
CASP1 P29466 1/20 0.35
CYP1B1 Q16678 1/20 0.34
ALPL P05186 2/20 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
SCHEMBL5685708 0.88 AHR (0.60) AHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL4459649 0.83 AHR (0.54) AHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL30301086 0.82 AHR (0.52) AHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL29492227 0.82 AHR (0.52) AHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL4453307 0.82 AHR (0.52) AHRCYP3A4ALDH1A1MAPK1TDP1
SCHEMBL2230317 0.82 AHR (0.52) AHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL4450215 0.82 CYP3A4 (0.42) AHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL4459037 0.80 CYP3A4 (0.50) AHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL4448789 0.80 CYP3A4 (0.58) AHRCYP3A4ALDH1A1MAPK1HPGD
SCHEMBL30621937 0.80 CYP3A4 (0.50) AHRCYP3A4ALDH1A1MAPK1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-222512307-U Undercarriage handle controlling device 上海航空电器有限公司 2025-02-21 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-111701144-B Systems and methods for phototherapy modulation of nitric oxide 诺欧生物有限责任公司 2023-03-21 CN disclosed
US-20090269857-A1 Instruments for detecting low-molecular weight substance FUJIKURA KASEI CO., LTD. (JP) 2009-10-29 US disclosed
US-20050148097-A1 Instruments for detecting low-molecular weight substance ENBIOTEC LABORATORIES C., LTD. (JP) 2005-07-07 US disclosed
EP-1489420-A1 INSTRUMENTS FOR DETECTING LOW-MOLECULAR WEIGHT SUBSTANCE Enbiotec Laboratories Co., Ltd. (JP) 2004-12-22 EP disclosed
US-4806514-A COATING ON POLYMER FILM OF A PYRIDINE POLYMER AND PORPHYRIN OR PHTHALOCYANINE DYE BLENDS CANADIAN PATENTS AND DEVELOPMENT LIMITED -SOCIETE CANADIENNE DES BREVETS ET D'EXPLOITATION LIMITEE (CA) 1989-02-21 US disclosed