SCHEMBL7926839

SCHEMBL7926839

COc1ccc(-c2cccc(N)c2)n2nc(C3(C(=O)N4CCOCC4)CC3)nc12

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 19/20 0.57
PDE4A P27815 1/20 0.55

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
SCHEMBL7922068 0.89 PDE4A (0.57) PDE4DPDE4A
SCHEMBL508821 0.89 PDE4D (0.62) PDE4DPDE4A
SCHEMBL509944 0.88 PDE4D (0.75) PDE4DPDE4A
SCHEMBL509391 0.83 PDE4D (0.60) PDE4DPDE4A
SCHEMBL508880 0.80 PDE4D (0.79) PDE4D
SCHEMBL7924103 0.79 PDE4D (0.52) PDE4DPDE4A
SCHEMBL509890 0.79 PDE4D (0.63) PDE4D
SCHEMBL7919088 0.79 PDE4D (0.64) PDE4D
SCHEMBL7924205 0.78 PDE4D (0.64) PDE4DPDE4A
SCHEMBL7927936 0.77 PDE4D (0.61) PDE4D

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-2010069322-A1 TRIAZOLOPYRIDINES AS PHOSPHODIESTERASE INHIBITORS FOR TREATMENT OF DERMAL DISEASES LEO PHARMA A/S (DK) 2010-06-24 WO disclosed