SCHEMBL8709489

SCHEMBL8709489

CCOC(C)OCCOC(=O)CC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.48
NAAA Q02083 1/20 0.44
ALDH1A1 P00352 5/20 0.36
CYP1A2 P05177 1/20 0.36
HPGD P15428 1/20 0.36
CYP2C19 P33261 1/20 0.36
BLM P54132 1/20 0.36
WRN Q14191 1/20 0.36
HIF1A Q16665 1/20 0.36
DGKA P23743 1/20 0.35
GAA P10253 2/20 0.35
HTT P42858 1/20 0.33
MGAM O43451 1/20 0.33
SI P14410 1/20 0.33
MGAM2 Q2M2H8 1/20 0.33
TSHR P16473 1/20 0.33
SOAT1 P35610 1/20 0.33
KDM4E B2RXH2 1/20 0.33
TRPA1 O75762 1/20 0.31
DNM1 Q05193 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
SCHEMBL652060 0.82 ALDH1A1 (0.54) LMNAALDH1A1GAAHTTTSHR
SCHEMBL17471938 0.82 NAAA (0.45) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL27630833 0.81 NAAA (0.48) LMNANAAAALDH1A1CYP1A2HPGD
SCHEMBL8661878 0.79 NAAA (0.47) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL16897753 0.78 NAAA (0.42) LMNANAAAALDH1A1DGKAGAA
SCHEMBL50301 0.78 NAAA (0.64) NAAAALDH1A1CYP1A2HPGDCYP2C19
SCHEMBL15416969 0.77 LMNA (0.55) LMNAALDH1A1DGKAGAAMGAM
SCHEMBL450595 0.76 NAAA (0.44) LMNANAAAALDH1A1CYP1A2HPGD
SCHEMBL472194 0.76 TSHR (0.52) LMNAALDH1A1HPGDHIF1ATSHR
SCHEMBL15159057 0.76 LMNA (0.43) LMNAALDH1A1TSHR

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
WO-1998018751-A1 PRESENTATION OF BIOACTIVES SCOTIA HOLDINGS PLC (GB) 1998-05-07 WO disclosed