SCHEMBL9344302

SCHEMBL9344302

Clc1ccc(Cl)c2c(Cl)ccc(Cl)c12

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 4/20 0.44
CYP1A2 P05177 2/20 0.44
TSHR P16473 5/20 0.43
LMNA P02545 2/20 0.43
AHR P35869 3/20 0.41
TP53 P04637 2/20 0.41
CYP3A4 P08684 3/20 0.37
HSD17B10 Q99714 2/20 0.37
MAPK1 P28482 1/20 0.37
ALDH1A1 P00352 2/20 0.35
TDP1 Q9NUW8 1/20 0.35
GPR84 Q9NQS5 1/20 0.35
CYP1B1 Q16678 1/20 0.33
IDO1 P14902 1/20 0.32

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
SCHEMBL29508990 1.00 CYP2A6 (0.44) CYP2A6CYP1A2TSHRLMNAAHR
SCHEMBL15517767 0.84 CYP2A6 (0.42) CYP2A6CYP1A2TSHRLMNAAHR
SCHEMBL8765414 0.79 CYP1A2 (0.32) CYP2A6CYP1A2TSHRLMNAAHR
SCHEMBL11813245 0.79 TSHR (0.43) TSHRTP53CYP3A4HSD17B10MAPK1
SCHEMBL7703939 0.77 HTR2A (0.37) CYP2A6CYP1A2LMNAMAPK1ALDH1A1
SCHEMBL1038312 0.77 CYP3A4 (0.47) CYP2A6CYP1A2TSHRLMNAAHR
SCHEMBL9512355 0.76 TSHR (0.39) CYP2A6CYP1A2TSHRLMNAAHR
SCHEMBL29962329 0.76 TSHR (0.39) CYP2A6CYP1A2TSHRLMNAAHR
SCHEMBL23624646 0.74 TSHR (0.43) CYP2A6CYP1A2TSHRLMNATP53
SCHEMBL11428765 0.74 S100A4 (0.44) CYP1A2TSHRLMNAMAPK1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114428145-A Method for measuring migration amount of polynaphthalene chloride in food contact material 广东产品质量监督检验研究院(国家质量技术监督局广州电气安全检验所、广东省试验认证研究院、华安实验室) 2022-05-03 CN claimed
CN-114428145-B Method for measuring migration amount of polynaphthalene chloride in food contact material 广东产品质量监督检验研究院(国家质量技术监督局广州电气安全检验所、广东省试验认证研究院、华安实验室) 2023-03-21 CN disclosed
CN-114428145-A Method for measuring migration amount of polynaphthalene chloride in food contact material 广东产品质量监督检验研究院(国家质量技术监督局广州电气安全检验所、广东省试验认证研究院、华安实验室) 2022-05-03 CN disclosed
EP-3564245-A1 NAPHTHOBISCHALCOGENADIAZOLE DERIVATIVE AND PRODUCTION METHOD THEREFOR Osaka University (JP) 2019-11-06 EP disclosed
WO-2018123207-A1 NAPHTHOBISCHALCOGENADIAZOLE DERIVATIVE AND PRODUCTION METHOD THEREFOR 国立大学法人大阪大学 2018-07-05 WO disclosed
US-5284942-A Process for the preparation of peri-dichalcogeno polycyclic aromatic compounds CIBA-GEIGY CORPORATION (US) 1994-02-08 US disclosed
EP-0504113-A1 Process for the preparation of peridichalcogenated aromatics CIBA-GEIGY AG (CH) 1992-09-16 EP disclosed