SCHEMBL8821099

SCHEMBL8821099

CC(=O)Oc1c(C)c(O)c(C)c(C)c1O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PREP P48147 3/20 0.42
CELA1 Q9UNI1 2/20 0.42
KDM4E B2RXH2 2/20 0.39
HSD17B10 Q99714 2/20 0.39
HTT P42858 2/20 0.39
TP53 P04637 1/20 0.39
GAA P10253 1/20 0.39
MAPT P10636 1/20 0.39
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
POLB P06746 1/20 0.37
LMNA P02545 1/20 0.37
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
CA2 P00918 1/20 0.33
KDR P35968 1/20 0.33
MAPK1 P28482 1/20 0.33
ACHE P22303 1/20 0.32

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
SCHEMBL5865884 0.76 LMNA (0.44) PREPCELA1KDM4EHSD17B10HTT
SCHEMBL9507056 0.76 LMNA (0.44) PREPCELA1KDM4EHSD17B10HTT
SCHEMBL6773360 0.76 PREP (0.36) PREPCELA1KDM4EHSD17B10HTT
SCHEMBL4459372 0.74 CYP3A4 (0.42) PREPCELA1KDM4EHSD17B10HTT
SCHEMBL13134484 0.74 LMNA (0.42) PREPCELA1KDM4EHSD17B10HTT
SCHEMBL7566198 0.73 POLB (0.54) PREPCELA1KDM4EHSD17B10HTT
SCHEMBL20075881 0.73 PREP (0.44) PREPCELA1KDM4EHSD17B10HTT
SCHEMBL5588225 0.71 IMPDH2 (0.36)
SCHEMBL2114307 0.71 POLB (0.53) PREPCELA1KDM4EHSD17B10HTT
SCHEMBL24445852 0.71 PREP (0.39) PREPCELA1KDM4EHSD17B10HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-9176150-A None JP disclosed
JP-H09176150-A PRODUCTION OF CHROMAN DERIVATIVE MITSUBISHI GAS CHEM CO INC 1997-07-08 JP disclosed