SCHEMBL8071506

SCHEMBL8071506

COc1ccc(Cc2ccc(F)cc2O)cc1-c1cccc(NO)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 4/20 0.48
PDE4D Q08499 1/20 0.44
HDAC4 P56524 1/20 0.40
HDAC2 Q92769 1/20 0.40
HDAC8 Q9BY41 1/20 0.40
CNR1 P21554 1/20 0.40
HTR7 P34969 2/20 0.39
MEN1 O00255 1/20 0.38
MAPT P10636 1/20 0.38
KMT2A Q03164 1/20 0.38
STK10 O94804 1/20 0.38
SLK Q9H2G2 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
CASR P41180 1/20 0.38
MMEL1 Q495T6 1/20 0.38
KCNH2 Q12809 1/20 0.38
FFAR1 O14842 1/20 0.37
ALOX5 P09917 1/20 0.37
GABRA1 P14867 1/20 0.37
GABRB2 P47870 1/20 0.37

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
SCHEMBL8065375 0.88 PDE4D (0.47) PDE4BPDE4DHDAC4HDAC2HDAC8
SCHEMBL8066904 0.88 PDE4D (0.54) PDE4BPDE4DHDAC4HDAC2HDAC8
SCHEMBL15906104 0.85 PDE4B (0.46) PDE4BPDE4DHDAC4HDAC2HDAC8
SCHEMBL8065317 0.81 PDE4D (0.47) PDE4BPDE4DHDAC4HDAC2HDAC8
SCHEMBL13578416 0.81 PDE4B (0.42) PDE4BPDE4DHDAC4HDAC2HDAC8
SCHEMBL8071940 0.81 PDE4D (0.51) PDE4BPDE4DHDAC4HDAC2HDAC8
SCHEMBL8069097 0.80 PDE4D (0.49) PDE4BPDE4DHDAC4HDAC2HDAC8
SCHEMBL3792967 0.80 CYP19A1 (0.48) PDE4BPDE4DMEN1MAPTKMT2A
SCHEMBL8066925 0.80 PDE4D (0.48) PDE4BPDE4DHDAC4HDAC2HDAC8
SCHEMBL8062938 0.79 PDE4B (0.47) PDE4BPDE4DHTR7MEN1MAPT

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-2009067600-A2 BIARYL PDE4 INHIBITORS FOR TREATING INFLAMMATION DECODE GENETICS EHF (IS) 2009-05-28 WO disclosed