SCHEMBL4450440

SCHEMBL4450440

Clc1cc(Cl)c(-c2c(Cl)ccc(Cl)c2Cl)cc1Cl

nearest known ligand 0.52

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
AHR P35869 12/20 0.52
MAPK1 P28482 2/20 0.52
TP53 P04637 1/20 0.36
CYP1B1 Q16678 1/20 0.36
CYP3A4 P08684 3/20 0.35
CES1 P23141 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
ALDH1A1 P00352 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
SCHEMBL29455135 1.00 AHR (0.52) AHRMAPK1TP53CYP1B1CYP3A4
SCHEMBL29624835 0.81 AHR (0.61) AHRMAPK1CYP1B1CYP3A4TSHR
SCHEMBL4449767 0.81 AHR (0.61) AHRMAPK1CYP1B1CYP3A4TSHR
SCHEMBL29624836 0.78 AHR (0.54) AHRMAPK1CYP1B1CYP3A4CES1
SCHEMBL29618916 0.78 TP53 (0.46) AHRTP53CYP3A4TSHRHSD17B10
SCHEMBL4450570 0.78 TP53 (0.46) AHRTP53CYP3A4TSHRHSD17B10
SCHEMBL4449764 0.78 AHR (0.54) AHRMAPK1CYP1B1CYP3A4CES1
SCHEMBL9734016 0.78 MAPK1 (0.41) AHRMAPK1ALDH1A1
SCHEMBL4453300 0.77 AHR (0.55) AHRMAPK1CES1TSHRALDH1A1
SCHEMBL4446978 0.77 AHR (0.55) AHRMAPK1CYP3A4TSHRHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3881907-A1 METHOD FOR DECHLORINATION OF ONE OR MORE AROMATIC ORGANOCHLORINE COMPOUND(S) CONTAINED IN AN OIL OR FORMING SAID OIL - ASSOCIATED ELECTRICAL/ELECTRONIC DEVICE AND INSTALLATION Université de Lille (FR) 2021-09-22 EP claimed
CN-119875009-A Preparation method of multi-template molecularly imprinted polymer for selectively adsorbing multiple pigments and application of multi-template molecularly imprinted polymer in solid-phase extraction packing 宁波大学 2025-04-25 CN disclosed
EP-3881907-A1 METHOD FOR DECHLORINATION OF ONE OR MORE AROMATIC ORGANOCHLORINE COMPOUND(S) CONTAINED IN AN OIL OR FORMING SAID OIL - ASSOCIATED ELECTRICAL/ELECTRONIC DEVICE AND INSTALLATION Université de Lille (FR) 2021-09-22 EP disclosed
US-9309483-B2 Membrane-based processes for reducing at least one impurity and making a concentrate comprising at least one natural component from a non-marine fatty acid oil mixture, and compositions resulting thereof EVONIK MEMBRANE EXTRACTION TECHNOLOGY LTD. (GB) 2016-04-12 US disclosed
US-20140296549-A1 MEMBRANE-BASED PROCESSES FOR REDUCING AT LEAST ONE IMPURITY AND MAKING A CONCENTRATE COMPRISING AT LEAST ONE NATURAL COMPONENT FROM A NON-MARINE FATTY ACID OIL MIXTURE, AND COMPOSITIONS RESULTING THEREOF EVONIK MEMBRANE EXTRACTION TECHNOLOGY LTD. (GB) 2014-10-02 US disclosed
EP-2776544-A1 MEMBRANE-BASED PROCESSES FOR REDUCING AT LEAST ONE IMPURITY AND MAKING A CONCENTRATE COMPRISING AT LEAST ONE NATURAL COMPONENT FROM A NON-MARINE FATTY ACID OIL MIXTURE, AND COMPOSITIONS RESULTING THEREOF Evonik Membrane Extraction Technology Limited (GB) 2014-09-17 EP disclosed
WO-2013068443-A1 MEMBRANE-BASED PROCESSES FOR REDUCING AT LEAST ONE IMPURITY AND MAKING A CONCENTRATE COMPRISING AT LEAST ONE NATURAL COMPONENT FROM A NON-MARINE FATTY ACID OIL MIXTURE, AND COMPOSITIONS RESULTING THEREOF SONDBOE SVERRE (NO) 2013-05-16 WO disclosed
US-20090269857-A1 Instruments for detecting low-molecular weight substance FUJIKURA KASEI CO., LTD. (JP) 2009-10-29 US disclosed
WO-2008113365-A2 DEVICE AND METHOD FOR ISOLATION, CONCENTRATION AND/OR IDENTIFICATION OF COMPOUNDS AARHUS UNIVERSITET (DK) 2008-09-25 WO 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