SCHEMBL8466532

SCHEMBL8466532

COc1ccc(-c2cccc(OC(N)=O)c2)cc1OC1CCCC1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 12/20 0.67
PDE4B Q07343 12/20 0.67
PDE4A P27815 11/20 0.67
PDE4C Q08493 10/20 0.67
FPR2 P25090 3/20 0.54
MAPK14 Q16539 1/20 0.52
POLB P06746 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
SCHEMBL8461658 0.91 PDE4D (0.71) PDE4DPDE4BPDE4APDE4CFPR2
SCHEMBL8462846 0.89 PDE4A (0.66) PDE4DPDE4BPDE4APDE4CFPR2
SCHEMBL8464657 0.89 PDE4B (0.73) PDE4DPDE4BPDE4APDE4CMAPK14
SCHEMBL8203884 0.86 PDE4A (0.67) PDE4DPDE4BPDE4APDE4CFPR2
SCHEMBL7435711 0.83 PDE4A (0.82) PDE4DPDE4BPDE4APDE4CFPR2
SCHEMBL7448547 0.81 PDE4A (0.82) PDE4DPDE4BPDE4APDE4CFPR2
SCHEMBL7406024 0.81 PDE4A (1.00) PDE4DPDE4BPDE4APDE4CFPR2
SCHEMBL5823060 0.80 PDE4A (0.77) PDE4DPDE4BPDE4APDE4CFPR2
SCHEMBL8465921 0.80 PDE4A (0.66) PDE4DPDE4BPDE4APDE4CFPR2
SCHEMBL6798284 0.80 PDE4A (0.65) PDE4DPDE4BPDE4APDE4CFPR2

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