SCHEMBL4947650

SCHEMBL4947650

COc1cccc(Nc2c(C(N)=O)cnc3c(S(=O)(=O)c4ccccc4)cccc23)c1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 19/20 0.75
PDE4A P27815 1/20 0.58
PDE4C Q08493 1/20 0.58
PDE4D Q08499 1/20 0.58
CYP1A2 P05177 1/20 0.51

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
SCHEMBL4952401 0.94 PDE4B (0.75) PDE4BPDE4APDE4CPDE4D
SCHEMBL4946547 0.90 PDE4B (0.77) PDE4BPDE4APDE4CPDE4D
SCHEMBL4946533 0.90 PDE4B (0.64) PDE4B
SCHEMBL4948607 0.89 PDE4B (0.68) PDE4BPDE4APDE4CPDE4D
SCHEMBL4948174 0.88 PDE4B (0.76) PDE4BPDE4APDE4CPDE4D
SCHEMBL4951341 0.87 PDE4B (0.66) PDE4BPDE4APDE4CPDE4D
SCHEMBL4944342 0.86 PDE4B (0.57) PDE4B
SCHEMBL4949247 0.86 PDE4B (0.56) PDE4B
SCHEMBL4627512 0.86 PDE4B (0.70) PDE4BPDE4APDE4CPDE4D
SCHEMBL1275367 0.85 PDE4B (1.00) PDE4BPDE4APDE4CPDE4D

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
EP-1633748-B1 QUINOLINE DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LTD (GB) 2008-03-05 EP claimed