SCHEMBL5820437

SCHEMBL5820437

COc1ccc(N2CCC(Cc3cccnc3)CC2)nc1OC1CCOC1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAP4K4 O95819 1/20 0.41
OGA O60502 2/20 0.38
FFAR4 Q5NUL3 1/20 0.37
CHRM4 P08173 1/20 0.37
PDE4A P27815 1/20 0.37
PDE4B Q07343 1/20 0.37
PDE4C Q08493 1/20 0.37
PDE4D Q08499 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM1 P11229 1/20 0.37
CHRM3 P20309 1/20 0.37
TSHR P16473 1/20 0.36
CHRNB2 P17787 1/20 0.36
CHRNA7 P36544 1/20 0.36
CHRNA4 P43681 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
SCHEMBL2901841 0.87 VCP (0.43) OGA
SCHEMBL2901839 0.87 VCP (0.43) OGA
SCHEMBL5820433 0.82
SCHEMBL2901836 0.81 PDE4D (0.37) PDE4APDE4BPDE4CPDE4D
SCHEMBL2908190 0.75 PDE4D (0.42) PDE4APDE4BPDE4CPDE4D
SCHEMBL4140487 0.74 PDE4D (0.39) FFAR4PDE4APDE4BPDE4CPDE4D
SCHEMBL2901989 0.73 PDE4D (0.42) PDE4APDE4BPDE4CPDE4D
SCHEMBL2908807 0.72 PDE4D (0.37) PDE4APDE4BPDE4CPDE4DCHRM2
SCHEMBL2909161 0.72 PDE4D (0.33) FFAR4PDE4APDE4BPDE4CPDE4D
SCHEMBL4136062 0.72 PDE4D (0.37) PDE4APDE4BPDE4CPDE4DCHRM2

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-1692109-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS Memory Pharmaceuticals Corporation (US) 2006-08-23 EP disclosed
WO-2005061458-A2 PHOSPHODIESTERASE 4 INHIBITORS, INCLUDING N-SUBSTITUTED DIARYLAMINE ANALOGS MEMORY PHARMACEUTICALS CORPORATION (US) 2005-07-07 WO disclosed