SCHEMBL7098396

SCHEMBL7098396

O=C(CCN1C(=O)C=CC1=O)OCCOC(=O)CCN1C(=O)C=CC1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 6/20 0.50
ALDH1A1 P00352 3/20 0.48
HPGD P15428 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
BLM P54132 1/20 0.48
WRN Q14191 1/20 0.48
HIF1A Q16665 1/20 0.48
PTGS1 P23219 6/20 0.47
PTGS2 P35354 6/20 0.47
GSK3A P49840 4/20 0.47
GSK3B P49841 4/20 0.47
FAAH O00519 3/20 0.46
MAPK1 P28482 2/20 0.45
MAPT P10636 2/20 0.45
RECQL P46063 2/20 0.45
HSP90AA1 P07900 1/20 0.45
TLR9 Q9NR96 1/20 0.45
LMNA P02545 1/20 0.45
TP53 P04637 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
SCHEMBL14984834 0.92 PTGS1 (0.49) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL5826261 0.91 MGLL (0.46) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL12021170 0.89 MGLL (0.44) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL5160607 0.89 ALDH1A1 (0.51) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL7098923 0.88 GSK3A (0.50) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL3874763 0.88 ALDH1A1 (0.63) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL14014719 0.88 MGLL (0.43) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL4887032 0.87 ALDH1A1 (0.42) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL14922154 0.87 NPSR1 (0.47) MGLLALDH1A1HPGDCYP1A2CYP2C19
SCHEMBL5166306 0.86 MAPK1 (0.58) MGLLALDH1A1HPGDCYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1339127-A1 SOLID POLYMER ELECTROLYTE AND CELL CONTAINING THE ELECTROLYTE DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-08-27 EP disclosed