SCHEMBL8464657

SCHEMBL8464657

COc1ccc(-c2ccc(OC(N)=O)cc2)cc1OC1CCCC1

nearest known ligand 0.73

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 14/20 0.73
PDE4A P27815 12/20 0.73
PDE4D Q08499 12/20 0.73
PDE4C Q08493 11/20 0.73
MAPK14 Q16539 1/20 0.55
POLB P06746 1/20 0.54

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
SCHEMBL8466532 0.89 PDE4D (0.67) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL8465769 0.88 PDE4A (0.67) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL7440108 0.84 PDE4B (1.00) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL5823060 0.83 PDE4A (0.77) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL7444846 0.82 PDE4A (1.00) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL8885266 0.82 PDE4B (0.81) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL8465041 0.81 PDE4A (0.71) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL7450822 0.81 PDE4A (0.71) PDE4BPDE4APDE4DPDE4CPOLB
SCHEMBL8461881 0.81 PDE4A (0.79) PDE4BPDE4APDE4DPDE4CMAPK14
SCHEMBL7501628 0.81 PDE4A (0.97) PDE4BPDE4APDE4DPDE4CMAPK14

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-0745063-B1 SUBSTITUTED BIPHENYL DERIVATIVES AS PHOSPHODIESTERASE INHIBITORS AMERICAN HOME PROD (US) 1999-03-24 EP claimed