SCHEMBL8066904

SCHEMBL8066904

COc1ccc(Cc2ccc(F)cc2)cc1-c1cccc(NO)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.54
PDE4B Q07343 4/20 0.50
HTR7 P34969 2/20 0.43
STK10 O94804 1/20 0.41
SLK Q9H2G2 1/20 0.41
CASR P41180 2/20 0.40
FFAR1 O14842 2/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
MAPT P10636 1/20 0.39
HDAC4 P56524 1/20 0.39
HDAC2 Q92769 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
CA2 P00918 1/20 0.39
GAA P10253 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
MMEL1 Q495T6 1/20 0.39
KCNH2 Q12809 1/20 0.38

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
SCHEMBL8071506 0.88 PDE4B (0.48) PDE4DPDE4BHTR7STK10SLK
SCHEMBL8062938 0.86 PDE4B (0.47) PDE4DPDE4BHTR7STK10SLK
SCHEMBL8056450 0.86 PDE4B (0.41) PDE4DPDE4BMEN1KMT2AMAPT
SCHEMBL8071940 0.85 PDE4D (0.51) PDE4DPDE4BHTR7FFAR1HDAC4
SCHEMBL8069097 0.85 PDE4D (0.49) PDE4DPDE4BHTR7CASRFFAR1
SCHEMBL8066338 0.84 PDE4D (0.53) PDE4DPDE4BHTR7FFAR1HDAC4
SCHEMBL8071935 0.82 KDM1A (0.39) PDE4DCA2
SCHEMBL8066867 0.82 PDE4B (0.46) PDE4DPDE4BHTR7FFAR1MEN1
SCHEMBL15906113 0.82 PDE4D (0.49) PDE4DPDE4BHTR7CASRMEN1
SCHEMBL8014205 0.82 PDE4B (0.46) PDE4DPDE4BHTR7FFAR1MEN1

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