SCHEMBL8053232

SCHEMBL8053232

COc1ccc(COC(C)C)nc1-c1cccc(NO)c1

nearest known ligand 0.45

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 17/20 0.45
PDE4D Q08499 3/20 0.45

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
SCHEMBL8024647 0.83 PDE4B (0.46) PDE4BPDE4D
SCHEMBL8071898 0.80 PDE4B (0.56) PDE4BPDE4D
SCHEMBL8028328 0.77 PDE4B (0.41) PDE4BPDE4D
SCHEMBL3793559 0.77 PDE4B (0.69) PDE4BPDE4D
SCHEMBL8071504 0.75 CXCR4 (0.46) PDE4B
SCHEMBL8072345 0.75 PDE4B (0.46) PDE4BPDE4D
SCHEMBL8070648 0.73 PDE4B (0.42) PDE4BPDE4D
SCHEMBL8066164 0.73 PDE4B (0.44) PDE4BPDE4D
SCHEMBL15906181 0.70 PDE4B (0.49) PDE4BPDE4D
SCHEMBL16158623 0.68 PDE4B (0.46) PDE4BPDE4D

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