SCHEMBL28021671

SCHEMBL28021671

O=C1OCCCC1c1cccc2ccccc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PLA2G6 O60733 4/20 0.53
MAPK1 P28482 3/20 0.53
ALDH1A1 P00352 2/20 0.53
MAPT P10636 2/20 0.53
HPGD P15428 2/20 0.53
BLM P54132 2/20 0.53
NPSR1 Q6W5P4 2/20 0.53
FAAH O00519 1/20 0.53
NPC1 O15118 1/20 0.53
GMNN O75496 1/20 0.53
LMNA P02545 1/20 0.53
MTOR P42345 1/20 0.53
RAB9A P51151 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
TRPC5 Q9UL62 1/20 0.53
TRPC6 Q9Y210 1/20 0.53
TP53 P04637 1/20 0.53
CYP3A4 P08684 1/20 0.53
PKM P14618 1/20 0.53
ALOX15 P16050 1/20 0.53

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
SCHEMBL27705875 0.95 PLA2G6 (0.52) PLA2G6MAPK1ALDH1A1MAPTHPGD
SCHEMBL6288863 0.90 PLA2G6 (0.56) PLA2G6MAPK1ALDH1A1MAPTHPGD
SCHEMBL27726500 0.80 IDO1 (0.53) PLA2G6MAPK1ALDH1A1MAPTHPGD
SCHEMBL28389155 0.78 DDB1 (0.46) ALDH1A1MAPTHPGDHSD17B10KDM4E
SCHEMBL4802338 0.76 IDO1 (0.51) PLA2G6MAPK1ALDH1A1MAPTHPGD
SCHEMBL28454262 0.75 HTR2C (0.41) MAPTHPGDLMNAHSD17B10ALOX12
SCHEMBL4800917 0.74 IDO1 (0.50) PLA2G6MAPK1ALDH1A1MAPTHPGD
SCHEMBL15874844 0.74 IDO1 (0.50) PLA2G6MAPK1ALDH1A1MAPTHPGD
SCHEMBL27705885 0.74 PLA2G6 (0.52) PLA2G6MAPK1ALDH1A1MAPTHPGD
SCHEMBL28389096 0.73 DDB1 (0.45) ALDH1A1MAPTHPGDHSD17B10KDM4E

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-115911573-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2023-04-04 CN disclosed
CN-106848406-B Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery 三菱化学株式会社 2020-09-11 CN disclosed
CN-105633345-B Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2020-01-17 CN disclosed
CN-108091826-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2018-05-29 CN disclosed
CN-106848406-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same 三菱化学株式会社 2017-06-13 CN disclosed
CN-102569893-B Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same MITSUBISHI CHEMICAL CORP. (JP) 2016-05-11 CN disclosed
CN-104868157-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same MITSUBISHI CHEM CORP 2015-08-26 CN disclosed