SCHEMBL576535

SCHEMBL576535

C#CCOC(=O)OCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
NPC1 O15118 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
ZDHHC20 Q5W0Z9 1/20 0.38
HCAR2 Q8TDS4 1/20 0.36
TSHR P16473 3/20 0.36
POLB P06746 1/20 0.35
LMNA P02545 1/20 0.34
CHRM1 P11229 2/20 0.33
ESR1 P03372 1/20 0.33
SLC6A2 P23975 1/20 0.33
KDR P35968 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CYP1A2 P05177 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM5 P08912 1/20 0.33
CYP2D6 P10635 1/20 0.33
NFKB1 P19838 1/20 0.33
CHRM3 P20309 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
SCHEMBL576499 0.88 ALDH1A1 (0.48) ALDH1A1NPC1L3MBTL1ZDHHC20HCAR2
SCHEMBL28559773 0.84 NAAA (0.50) ALDH1A1L3MBTL1ZDHHC20HCAR2TSHR
SCHEMBL291486 0.83 NPC1 (0.48) ALDH1A1NPC1L3MBTL1ZDHHC20TSHR
SCHEMBL27780402 0.83 NAAA (0.48) ALDH1A1L3MBTL1ZDHHC20HCAR2TSHR
SCHEMBL16864190 0.83 NPC1 (0.38) ALDH1A1NPC1L3MBTL1ZDHHC20HCAR2
SCHEMBL576751 0.82
SCHEMBL18537904 0.82 TSHR (0.42) ALDH1A1NPC1L3MBTL1ZDHHC20TSHR
Ethyne SCHEMBL165176 0.81 ALDH1A1 (0.50) ALDH1A1HCAR2TSHRLMNACHRM1
SCHEMBL17057 0.81 ALDH1A1 (0.56) ALDH1A1HCAR2TSHRLMNACHRM1
SCHEMBL10011102 0.79 L3MBTL1 (0.50) ALDH1A1NPC1L3MBTL1ZDHHC20TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024095797-A1 ELECTROLYTE SOLUTION, ELECTROCHEMICAL DEVICE, SECONDARY BATTERY, AND LITHIUM ION SECONDARY BATTERY ダイキン工業株式会社 2024-05-10 WO disclosed
CN-111628217-B Electrolyte for lithium ion secondary battery, and assembly 丰田自动车株式会社 2023-12-15 CN disclosed
US-20230395857-A1 NON-AQUEOUS ELECTROLYTE SOLUTION AND NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY EMPLOYING THE SAME MITSUBISHI CHEMICAL CORPORATION (JP) 2023-12-07 US disclosed
US-11791499-B2 Non-aqueous electrolyte solution and non-aqueous electrolyte secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2023-10-17 US disclosed
WO-2023167196-A1 ELECTRODE ACTIVE MATERIAL, ELECTRODE, ELECTROCHEMICAL DEVICE, MODULE AND METHOD 国立大学法人京都大学 2023-09-07 WO disclosed
EP-3528330-B1 NON-AQUEOUS ELECTROLYTE SECONDARY BATTERY MITSUBISHI CHEM CORP (JP) 2023-07-26 EP disclosed
US-11616253-B2 Nonaqueous electrolyte for secondary battery and nonaqueous-electrolyte secondary battery employing the same MITSUBISHI CHEMICAL CORPORATION (JP) 2023-03-28 US disclosed
CN-111433964-B Electrolyte solution, electrochemical device, lithium ion secondary battery, and assembly 大金工业株式会社 2023-02-17 CN disclosed
CN-115668569-A Electrolyte solution, electrochemical device, lithium ion secondary battery, and assembly 大金工业株式会社 2023-01-31 CN disclosed
CN-115668571-A Electrolyte solution, electrochemical device, lithium ion secondary battery, module, and compound 大金工业株式会社 2023-01-31 CN disclosed
CN-100517853-C Nonaqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same UBE INDUSTRIES (JP) 2009-07-22 CN disclosed
CN-100474688-C Nonaqueous electrolytic solution and lithium secondary battery UBE INDUSTRIES (JP) 2009-04-01 CN disclosed
US-20090053598-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME MU IONIC SOLUTIONS CORPORATION (JP) 2009-02-26 US disclosed
CN-101107745-A Nonaqueous electrolyte solution and lithium secondary battery using same UBE INDUSTRIES (JP) 2008-01-16 CN disclosed
US-20070231707-A1 Nonaqueous Electrolytic Solution and Lithium Secondary Battery MU IONIC SOLUTIONS CORPORATION (JP) 2007-10-04 US disclosed
CN-1989647-A Nonaqueous electrolytic solution and lithium secondary battery UBE INDUSTRIES (JP) 2007-06-27 CN disclosed
EP-1772924-A1 NONAQUEOUS ELECTROLYTIC SOLUTION AND LITHIUM SECONDARY BATTERY Ube Industries, Ltd. (JP) 2007-04-11 EP disclosed
CN-1853307-A Nonaqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same UBE INDUSTRIES (JP) 2006-10-25 CN disclosed
US-20060177742-A1 Nonaqueous electrolytic solution for lithium secondary battery and lithium secondary battery using the same MU IONIC SOLUTIONS CORPORATION (JP) 2006-08-10 US disclosed
EP-1650826-A1 NONAQUEOUS ELECTROLYTIC SOLUTION FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY USING SAME Ube Industries, Ltd. (JP) 2006-04-26 EP disclosed