SCHEMBL7922068

SCHEMBL7922068

COc1ccc(-c2ccc(N)cc2)n2nc(C3(C(=O)N4CCOCC4)CC3)nc12

nearest known ligand 0.57

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 2/20 0.57
PDE4D Q08499 19/20 0.51
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46

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
SCHEMBL7924103 0.90 PDE4D (0.52) PDE4APDE4DPDE4BPDE4C
SCHEMBL7926839 0.89 PDE4D (0.57) PDE4APDE4D
SCHEMBL509391 0.88 PDE4D (0.60) PDE4APDE4D
SCHEMBL509944 0.83 PDE4D (0.75) PDE4APDE4D
SCHEMBL7919041 0.82 PDE4D (0.62) PDE4D
SCHEMBL510003 0.78 PDE4D (0.61) PDE4D
SCHEMBL7927497 0.76 PDE4D (0.62) PDE4APDE4DPDE4BPDE4C
SCHEMBL7931731 0.75 PDE4D (0.61) PDE4APDE4DPDE4BPDE4C
SCHEMBL509307 0.75 PDE4D (0.58) PDE4D
SCHEMBL508880 0.74 PDE4D (0.79) 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