SCHEMBL27780428

SCHEMBL27780428

C#CC(CCCC)OC(=O)O

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CA2 P00918 5/20 0.41
MAPK1 P28482 1/20 0.41
CA1 P00915 3/20 0.37
GPR84 Q9NQS5 5/20 0.35
FFAR1 O14842 1/20 0.35
SLC1A3 P43003 1/20 0.35
SLC1A2 P43004 1/20 0.35
SLC1A1 P43005 1/20 0.35
MAPT P10636 1/20 0.34
LCK P06239 1/20 0.34
PPARD Q03181 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.34
ZDHHC2 Q9UIJ5 1/20 0.34
CTSK P43235 2/20 0.33
LMNA P02545 1/20 0.33
FDPS P14324 1/20 0.33
ACHE P22303 1/20 0.33
BACE1 P56817 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
SCHEMBL28216788 0.90 CHRM1 (0.38) SLC1A3SLC1A2SLC1A1MAPTLMNA
SCHEMBL5165702 0.82 CA2 (0.42) CA2MAPK1CA1SLC1A3SLC1A2
SCHEMBL14775528 0.81
SCHEMBL10476527 0.80 LMNA (0.40) GPR84FFAR1MAPTPPARDLMNA
SCHEMBL10012523 0.79 AKR1B1 (0.47) MAPK1GPR84FFAR1MAPTPPARD
SCHEMBL10011001 0.79 TSHR (0.43) GPR84FFAR1PPARDLMNA
SCHEMBL11606407 0.78 FAAH (0.40) CA2CA1GPR84FFAR1MAPT
SCHEMBL11512138 0.78 FAAH (0.40) CA2CA1GPR84FFAR1MAPT
SCHEMBL11512142 0.78 FAAH (0.40) CA2CA1GPR84FFAR1MAPT
SCHEMBL27780478 0.78 CA2 (0.39) CA2MAPK1CA1GPR84FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105633345-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same MITSUBISHI CHEM CORP 2016-06-01 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
CN-102569893-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same MITSUBISHI CHEM CORP 2012-07-11 CN disclosed
CN-102544585-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same MITSUBISHI CHEM CORP JP 2012-07-04 CN disclosed
CN-101652894-A Nonaqueous electrolyte solution for secondary battery and nonaqueous electrolyte secondary battery using same MITSUBISHI CHEM CORP JP 2010-02-17 CN disclosed