SCHEMBL1004018

SCHEMBL1004018

Cc1c(Cl)cc(Cl)c(Cl)c1Cl

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 5/20 0.59
HPGD P15428 5/20 0.46
HSD17B10 Q99714 5/20 0.46
TSHR P16473 5/20 0.46
MAPK1 P28482 3/20 0.46
CASP1 P29466 1/20 0.43
ALDH1A1 P00352 1/20 0.40
HSP90AA1 P07900 2/20 0.39
CRHBP P24387 1/20 0.36
CRHR2 Q13324 1/20 0.36
AHR P35869 8/20 0.36
SIRT1 Q96EB6 1/20 0.35
CHRM1 P11229 2/20 0.33
ALOX15 P16050 2/20 0.33
TBXA2R P21731 2/20 0.33
ADRA1A P35348 2/20 0.33
HTR2B P41595 2/20 0.33
RAPGEF4 Q8WZA2 1/20 0.33
AKR1B1 P15121 1/20 0.33
MEN1 O00255 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
SCHEMBL28035980 0.87 CYP3A4 (0.47) CYP3A4HPGDHSD17B10TSHRMAPK1
SCHEMBL25978067 0.81 CYP3A4 (0.50) CYP3A4HPGDHSD17B10TSHRMAPK1
SCHEMBL1547849 0.80 CYP3A4 (0.56) CYP3A4HPGDHSD17B10TSHRMAPK1
SCHEMBL1006177 0.79 CYP3A4 (0.43) CYP3A4ALDH1A1SIRT1CHRM1ALOX15
SCHEMBL31465325 0.79 CYP3A4 (0.43) CYP3A4ALDH1A1SIRT1CHRM1ALOX15
SCHEMBL8148096 0.79 CYP3A4 (0.47) CYP3A4HPGDHSD17B10TSHRMAPK1
Water SCHEMBL28512050 0.77 CYP3A4 (0.42) CYP3A4ALDH1A1SIRT1CHRM1ALOX15
SCHEMBL28492412 0.77 CYP3A4 (0.42) CYP3A4ALDH1A1SIRT1CHRM1ALOX15
SCHEMBL10345894 0.76 LMNA (0.47) CYP3A4SIRT1CHRM1ADRA1AHTR2B
SCHEMBL11406389 0.76 CYP3A4 (0.41) CYP3A4HPGDHSD17B10TSHRMAPK1

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 149 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108219792-B Quantum dot purification method, quantum dot, device and quantum dot composition 纳晶科技股份有限公司 2021-05-07 CN claimed
CN-111796040-B Method for separating isomeride chlorobenzene and toluene chloride by adopting gas chromatography-mass spectrometry 南京海关工业产品检测中心 2021-03-16 CN claimed
CN-111796040-A Method for separating isomeride chlorobenzene and toluene chloride by adopting gas chromatography-mass spectrometry 南京海关工业产品检测中心 2020-10-20 CN claimed
CN-106752080-B Disperse dye composition and preparation method and application thereof 浙江闰土研究院有限公司 2020-09-01 CN claimed
WO-2020125058-A1 QUANTUM DOT PURIFICATION METHOD TCL科技集团股份有限公司 2020-06-25 WO claimed
CN-106833023-B Disperse dye composition and preparation method and application thereof 浙江闰土研究院有限公司 2020-05-01 CN claimed
CN-106590027-B Disperse dye composition and preparation method and application thereof 浙江闰土研究院有限公司 2020-05-01 CN claimed
CN-106752079-B Disperse dye composition and preparation method and application thereof 浙江闰土研究院有限公司 2020-05-01 CN claimed
CN-106752081-B Disperse dye composition and preparation method and application thereof 浙江闰土研究院有限公司 2020-05-01 CN claimed
CN-106800798-B Disperse dye composition and preparation method and application thereof 浙江闰土研究院有限公司 2019-12-06 CN claimed
US-7998623-B2 Electrolyte for lithium ion secondary battery and lithium ion secondary battery including the same SAMSUNG SDI CO., LTD. (KR) 2011-08-16 US claimed
US-20060160000-A1 Electrolyte for lithium rechargeable battery and lithium rechargeable battery comprising the same SAMSUNG SDI CO., LTD. (KR) 2006-07-20 US claimed
US-20060078792-A1 Electrolyte for lithium ion secondary battery and lithium ion secondary battery including the same SAMSUNG SDI CO., LTD. (KR) 2006-04-13 US claimed
CN-1294109-A Catalyst for preparing 1-hexene from ethene by oligomerization and its application RES INST OPF DAQING PETRO CHEM (CN) 2001-05-09 CN claimed
EP-0558997-B1 Process for reducing the halogen-content of polyhalogenated aromatics BAYER AG (DE) 1995-11-22 EP claimed
US-5292975-A Platinum metal catalyst BAYER AKTIENGESELLSCHAFT (DE) 1994-03-08 US claimed
CN-116656363-B Treatment method and application of quantum dot surface ligand 北京科技大学 2024-08-23 CN disclosed
CN-115651422-B Synthesis method of environment-friendly heterocyclic disperse red dye 杭州吉华江东化工有限公司 2024-02-09 CN disclosed
US-4250122-A DIMETHYLDICHLORO-THIANTHRENE AND FERRIC CHLORIDE HOOKER CHEMICALS & PLASTICS CORP. (US) 1981-02-10 US disclosed
US-4031146-A O-CHLOROTOLUENE, CHLORINE, CATALYST TENNECO CHEMICALS, INC. (US) 1977-06-21 US disclosed