SCHEMBL4454517

SCHEMBL4454517

Clc1ccc(-c2ccc(Cl)c(Cl)c2Cl)c(Cl)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AHR P35869 5/20 0.56
TP53 P04637 3/20 0.52
HSP90AA1 P07900 1/20 0.44
HSP90AB1 P08238 1/20 0.44
HSD11B1 P28845 1/20 0.44
TSHR P16473 5/20 0.41
ALDH1A1 P00352 4/20 0.41
CYP3A4 P08684 3/20 0.41
HSD17B10 Q99714 2/20 0.41
TDP1 Q9NUW8 2/20 0.41
KDM4E B2RXH2 1/20 0.40
MGAM O43451 1/20 0.40
GAA P10253 1/20 0.40
SI P14410 1/20 0.40
RAB9A P51151 1/20 0.40
MGAM2 Q2M2H8 1/20 0.40
S100A4 P26447 1/20 0.39
MAPT P10636 1/20 0.39
CRHR1 P34998 1/20 0.39
MAPK1 P28482 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
SCHEMBL4459079 0.86 AHR (0.52) AHRTP53TSHRALDH1A1CYP3A4
SCHEMBL29624840 0.84 AHR (0.64) AHRTP53HSP90AA1HSP90AB1HSD11B1
SCHEMBL464507 0.84 AHR (0.64) AHRTP53HSP90AA1HSP90AB1HSD11B1
SCHEMBL29355007 0.84 AHR (0.59) AHRTP53HSP90AA1HSP90AB1HSD11B1
SCHEMBL4456776 0.84 AHR (0.59) AHRTP53HSP90AA1HSP90AB1HSD11B1
SCHEMBL4449749 0.82 AHR (0.52) AHRTP53HSD11B1TSHRALDH1A1
SCHEMBL308791 0.82 AHR (0.62) AHRTSHRCYP3A4TDP1MAPK1
SCHEMBL30336978 0.80 TP53 (0.57) AHRTP53HSP90AA1HSP90AB1HSD11B1
SCHEMBL4446831 0.80 TP53 (0.57) AHRTP53HSP90AA1HSP90AB1HSD11B1
SCHEMBL4450365 0.79 AHR (0.56) AHRTP53TSHRALDH1A1CYP3A4

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 10 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-110558613-B Aerosol generating device and electronic cigarette 上海新型烟草制品研究院有限公司 2024-12-20 CN disclosed
CN-118692506-A Disk device 株式会社 东芝 2024-09-24 CN disclosed
CN-118499855-A Novel far infrared warmer 嘉兴烯纳新材料科技有限公司 2024-08-16 CN disclosed
US-20230330725-A1 VOLATILIZATION AND OXIDATION OF ORGANIC WASTE NATIONAL BANK OF CANADA (CA) 2023-10-19 US disclosed
CN-115939883-A Cable protection cover for increasing pull-out resistance 泰科电子连接印度私有有限公司 2023-04-07 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-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