SCHEMBL3391433

SCHEMBL3391433

CC(=O)OCC(C)CCCCOC=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.39
PTPN1 P18031 1/20 0.38
USP2 O75604 4/20 0.37
ALDH1A1 P00352 3/20 0.37
CYP3A4 P08684 3/20 0.37
MAPT P10636 3/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
HPGD P15428 1/20 0.37
MEN1 O00255 1/20 0.34
TP53 P04637 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
LMNA P02545 1/20 0.32
RECQL P46063 1/20 0.32
CNR1 P21554 2/20 0.30
CNR2 P34972 2/20 0.30
FAAH O00519 1/20 0.30

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
SCHEMBL3389429 0.95 ALOX15 (0.40) ALOX15PTPN1USP2ALDH1A1CYP3A4
SCHEMBL3388433 0.88 ALOX15 (0.46) ALOX15PTPN1USP2ALDH1A1CYP3A4
SCHEMBL3391435 0.87 ALOX15 (0.42) ALOX15PTPN1USP2ALDH1A1CYP3A4
SCHEMBL17466185 0.82 ALDH1A1 (0.47) ALOX15PTPN1USP2ALDH1A1CYP3A4
SCHEMBL3389432 0.81 ALOX15 (0.44) ALOX15PTPN1USP2ALDH1A1CYP3A4
SCHEMBL3389402 0.81 ALOX15 (0.56) ALOX15PTPN1ALDH1A1SMN1; SMN2LMNA
SCHEMBL14621698 0.81 ALOX15 (0.39) ALOX15PTPN1USP2ALDH1A1CYP3A4
SCHEMBL3389764 0.79 TSHR (0.40) ALOX15ALDH1A1MAPTSMN1; SMN2CNR1
SCHEMBL20630298 0.78 ALDH1A1 (0.50) ALOX15PTPN1USP2ALDH1A1CYP3A4
SCHEMBL2160886 0.78 TDP1 (0.38) ALOX15PTPN1USP2ALDH1A1CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1729365-B1 NON-AQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING THE SAME UBE INDUSTRIES (JP) 2010-12-22 EP disclosed
US-20080241704-A1 Nonaqueous Electrolyte Solution and Lithium Secondary Battery Using Same UBE INDUSTRIES, LTD (JP) 2008-10-02 US disclosed
EP-1729365-A1 NONAQUEOUS ELECTROLYTE SOLUTION AND LITHIUM SECONDARY BATTERY USING SAME Ube Industries, Ltd. (JP) 2006-12-06 EP disclosed