SCHEMBL6952933

SCHEMBL6952933

COc1ccc(N(Cc2cccnc2)c2cccc(OCCc3ncc[nH]3)c2)cc1OC1CCCC1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 9/20 0.48
PDE4D Q08499 5/20 0.48
PDE4B Q07343 3/20 0.48
PDE4C Q08493 3/20 0.48
GRM2 Q14416 4/20 0.42
FGFR1 P11362 2/20 0.41
FGFR2 P21802 2/20 0.41
FGFR4 P22455 2/20 0.41
FGFR3 P22607 2/20 0.41
KDR P35968 2/20 0.41
OPRM1 P35372 1/20 0.37
OPRD1 P41143 1/20 0.37
PTAFR P25105 1/20 0.36
CTSD P07339 1/20 0.36
BACE1 P56817 1/20 0.36
BACE2 Q9Y5Z0 1/20 0.36

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
SCHEMBL1157824 0.87 PDE4A (0.52) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL1157687 0.87 PDE4A (0.58) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL1158532 0.84 PDE4A (0.49) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL4193023 0.83 PDE4A (0.48) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL4199907 0.82 PDE4A (0.47) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL1157704 0.82 PDE4A (0.61) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL1157497 0.81 PDE4A (0.62) PDE4APDE4DPDE4BPDE4C
SCHEMBL1157251 0.81 PDE4A (0.60) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL3202108 0.81 PDE4A (0.49) PDE4APDE4DPDE4BPDE4CGRM2
SCHEMBL1158956 0.81 PDE4A (0.54) PDE4APDE4DPDE4BPDE4CGRM2

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
EP-1353907-A2 PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceutical Corporation (US) 2003-10-22 EP claimed
WO-2002074726-A2 ANILINE DERIVATIVES USEFUL AS PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2002-09-26 WO claimed