SCHEMBL3265407

SCHEMBL3265407

CCC(=O)Oc1ccc(N(Cc2cccnc2)c2ccc(OC)c(OC3CCCC3)c2)cc1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 9/20 0.54
PDE4D Q08499 5/20 0.54
PDE4B Q07343 4/20 0.54
PDE4C Q08493 4/20 0.54
TP53 P04637 2/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
HTT P42858 1/20 0.43
PDK1 Q15118 1/20 0.41
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
GRM2 Q14416 1/20 0.40

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
SCHEMBL1157251 0.89 PDE4A (0.60) PDE4APDE4DPDE4BPDE4CTP53
SCHEMBL7948752 0.87 PDE4A (0.51) PDE4APDE4DPDE4BPDE4CTP53
SCHEMBL3129241 0.86 PDE4A (0.54) PDE4APDE4DPDE4BPDE4CTP53
SCHEMBL1157624 0.86 PDE4A (0.57) PDE4APDE4DPDE4BPDE4C
SCHEMBL3192669 0.86 PDE4A (0.53) PDE4APDE4DPDE4BPDE4CTP53
SCHEMBL3126137 0.86 PDE4A (0.61) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL1157609 0.86 PDE4A (0.58) PDE4APDE4DPDE4BPDE4CPDK1
SCHEMBL1157309 0.86 PDE4A (0.58) PDE4APDE4DPDE4BPDE4C
SCHEMBL1157358 0.86 PDE4A (0.60) PDE4APDE4DPDE4BPDE4C
SCHEMBL1157497 0.86 PDE4A (0.62) PDE4APDE4DPDE4BPDE4C

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
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO claimed
WO-2010003084-A2 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2010-01-07 WO disclosed