SCHEMBL8066925

SCHEMBL8066925

COc1ccc(Cc2ccccc2CN)cc1-c1cccc(NO)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDE4D Q08499 1/20 0.48
▸ PDE4B Q07343 5/20 0.41
▸ HTR7 P34969 4/20 0.41
▸ GABRA1 P14867 2/20 0.37
▸ GABRB2 P47870 2/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ CNR2 P34972 1/20 0.37
▸ HDAC4 P56524 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ HDAC8 Q9BY41 1/20 0.37
▸ FFAR1 O14842 1/20 0.36
▸ JAK2 O60674 1/20 0.36
▸ JAK3 P52333 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ ALDH1A1 P00352 1/20 0.35
▸ LMNA P02545 1/20 0.35
▸ MAPT P10636 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.35

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
SCHEMBL8065317 0.90 PDE4D (0.47) PDE4DPDE4BHTR7GABRA1GABRB2
SCHEMBL8065375 0.87 PDE4D (0.47) PDE4DPDE4BHTR7GABRA1GABRB2
SCHEMBL8067030 0.87 PDE4D (0.49) PDE4DPDE4BHTR7GABRA1GABRB2
SCHEMBL8066338 0.86 PDE4D (0.53) PDE4DPDE4BHTR7HDAC4HDAC2
SCHEMBL8067909 0.84 PDE4D (0.45) PDE4DPDE4BHTR7GABRA1GABRB2
SCHEMBL8066158 0.84 PDE4D (0.48) PDE4DPDE4BHTR7HDAC4HDAC2
SCHEMBL15906186 0.83 TP53 (0.45) PDE4DPDE4BHTR7GABRA1GABRB2
SCHEMBL8066904 0.80 PDE4D (0.54) PDE4DPDE4BHTR7HDAC4HDAC2
SCHEMBL8071940 0.80 PDE4D (0.51) PDE4DPDE4BHTR7HDAC4HDAC2
SCHEMBL13578467 0.80 PDE4D (0.42) PDE4DPDE4BHTR7GABRA1GABRB2

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
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