SCHEMBL4459798

SCHEMBL4459798

Clc1ccccc1-c1cc(Cl)c(Cl)c(Cl)c1Cl

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 3/20 0.50
CYP2A6 P11509 1/20 0.46
CYP3A4 P08684 2/20 0.46
DPP4 P27487 1/20 0.43
PLA2G7 Q13093 1/20 0.42
HSP90AA1 P07900 2/20 0.41
HSP90AB1 P08238 1/20 0.41
LMNA P02545 2/20 0.41
TSHR P16473 2/20 0.41
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
HPGD P15428 2/20 0.40
TP53 P04637 1/20 0.40
PTPRC P08575 1/20 0.39
POLB P06746 2/20 0.38
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 2/20 0.38
HSD11B1 P28845 1/20 0.38
HSD17B10 Q99714 2/20 0.37

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
SCHEMBL4453591 0.84 AHR (0.48) AHRCYP3A4HSP90AA1TSHRHPGD
SCHEMBL30444732 0.84 AHR (0.48) AHRCYP3A4HSP90AA1TSHRHPGD
SCHEMBL2230314 0.82 CYP3A4 (0.67) AHRCYP3A4HSP90AA1TSHRHPGD
SCHEMBL30034845 0.82 CYP3A4 (0.67) AHRCYP3A4HSP90AA1TSHRHPGD
SCHEMBL7081176 0.80 AHR (0.45) AHRCYP2A6CYP3A4HSP90AA1HSP90AB1
SCHEMBL28795908 0.80 ALDH1A1 (0.54) AHRCYP3A4PLA2G7HSP90AA1HSP90AB1
SCHEMBL7604144 0.80 HPGD (0.48) AHRCYP3A4HSP90AA1HSP90AB1TSHR
SCHEMBL4453348 0.79 ALDH1A1 (0.48) AHRCYP2A6DPP4PLA2G7LMNA
SCHEMBL29765253 0.79 ALDH1A1 (0.48) AHRCYP2A6DPP4PLA2G7LMNA
SCHEMBL29883244 0.79 CYP2A6 (0.67) CYP2A6DPP4PLA2G7LMNATSHR

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 5 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
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-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