SCHEMBL9832963

SCHEMBL9832963

ClC1(c2ccccc2)CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 3/20 0.47
SLC6A2 P23975 2/20 0.47
SLC6A3 Q01959 2/20 0.47
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47
CYP2B6 P20813 1/20 0.47
PRCP P42785 1/20 0.47
GRIN1 Q05586 1/20 0.47
KCNH2 Q12809 1/20 0.47
GRIN2A Q12879 1/20 0.47
GRIN2B Q13224 1/20 0.47
GRIN2C Q14957 1/20 0.47
GRIN3A Q8TCU5 1/20 0.47
SIGMAR1 Q99720 1/20 0.47
OPRM1 P35372 1/20 0.45
OPRD1 P41143 1/20 0.45
DPP4 P27487 1/20 0.45
AKR1C1 Q04828 1/20 0.45

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
SCHEMBL11026382 0.87 ESR1 (0.42) SLC6A4SLC6A2SLC6A3
SCHEMBL3823998 0.87 PNMT (0.48) OPRM1DPP4AKR1C1
SCHEMBL9782973 0.75 SLC6A4 (0.41) SLC6A4SLC6A3OPRM1DPP4AKR1C1
SCHEMBL28378542 0.74 ESR1 (0.58) SLC6A4SLC6A2SLC6A3GRIN2DGRIN3B
SCHEMBL30877902 0.74 ESR1 (0.58) SLC6A4SLC6A2SLC6A3GRIN2DGRIN3B
SCHEMBL24157288 0.74 ESR1 (0.58) SLC6A4SLC6A2SLC6A3GRIN2DGRIN3B
SCHEMBL30877914 0.74 ESR1 (0.58) SLC6A4SLC6A2SLC6A3GRIN2DGRIN3B
SCHEMBL30078304 0.74 ESR1 (0.58) SLC6A4SLC6A2SLC6A3GRIN2DGRIN3B
SCHEMBL868923 0.74 SLC6A4 (0.50) SLC6A4SLC6A2SLC6A3GRIN2DGRIN3B
SCHEMBL54982 0.74 ESR1 (0.58) SLC6A4SLC6A2SLC6A3GRIN2DGRIN3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1938894-A Nonaqueous electrolyte solution and lithium secondary battery UBE INDUSTRIES (JP) 2007-03-28 CN claimed
CN-119431102-A Halogenated cyclohexylbenzene compound and preparation method thereof 棓诺(张家港)新材料有限公司 2025-02-14 CN disclosed
CN-103443245-B Mesogenic compounds, liquid-crystalline media and components for high-frequency technology 默克专利股份有限公司 2016-07-13 CN disclosed
CN-103429704-B Mesogenic compounds, liquid-crystalline media and components for high-frequency technology 默克专利股份有限公司 2016-06-22 CN disclosed
CN-100355143-C Secondary lithium battery UBE INDUSTRIES (JP) 2007-12-12 CN disclosed
CN-1938894-A Nonaqueous electrolyte solution and lithium secondary battery UBE INDUSTRIES (JP) 2007-03-28 CN disclosed
CN-1672286-A Lithium secondary battery UBE INDUSTRIES (JP) 2005-09-21 CN disclosed
EP-0217748-B1 2-Substituted-e-fused-[1,2,4,]triazolo-[1,5-c]pyrimidines pharmaceutical compositions and uses thereof CIBA-GEIGY AG (CH) 1991-02-06 EP disclosed
US-4990707-A Process for the ring chlorination of aromatic hydrocarbons BAYER AKTIENGESELLSCHAFT (DE) 1991-02-05 US disclosed
EP-0368063-A1 Process for the chlorination in the nucleus of aromatic hydrocarbons BAYER AG (DE) 1990-05-16 EP disclosed
EP-0074608-B1 LIQUID CRYSTAL HALOGEN COMPOUNDS, PROCESS FOR THEIR PREPARATION, DIELECTRIC AND DECTROOPTICAL DISPLAY ELEMENT CONTAINING THEM MERCK PATENT GmbH (DE) 1985-07-03 EP disclosed
US-4490305-A Liquid-crystalline halogen compounds, process for their preparation, dielectrics containing these, and electro-optical display element MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1984-12-25 US disclosed
EP-0074608-A2 Liquid crystal halogen compounds, process for their preparation, dielectric and dectrooptical display element containing them MERCK PATENT GmbH (DE) 1983-03-23 EP disclosed