SCHEMBL7020430

SCHEMBL7020430

CCc1cc2c(OC(=O)Nc3c(F)cc(F)cc3F)cnc(OC)c2o1

nearest known ligand 0.60

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 10/20 0.60
PDE4B Q07343 10/20 0.60
PDE4C Q08493 10/20 0.60
PDE4D Q08499 10/20 0.60
ABCB1 P08183 1/20 0.31
SLC22A12 Q96S37 2/20 0.31
PIK3C3 Q8NEB9 2/20 0.30
KDM4E B2RXH2 1/20 0.30
TSHR P16473 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL7018517 0.91 PDE4D (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL7021594 0.85 PDE4D (0.59) PDE4APDE4BPDE4CPDE4D
SCHEMBL7019218 0.82 PDE4B (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL7016598 0.80 PDE4A (0.67) PDE4APDE4BPDE4CPDE4D
SCHEMBL7020167 0.79 PDE4A (0.49) PDE4APDE4BPDE4CPDE4DSLC22A12
SCHEMBL7021808 0.78 PDE4A (0.48) PDE4APDE4BPDE4CPDE4DKDM4E
SCHEMBL7019362 0.78 PDE4A (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL7014555 0.78 PDE4A (0.75) PDE4APDE4BPDE4CPDE4D
SCHEMBL7020449 0.77 PDE4A (0.76) PDE4APDE4BPDE4CPDE4D
SCHEMBL7020796 0.76 PDE4B (0.50) PDE4APDE4BPDE4CPDE4D

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-1086106-B1 FUROPYRIDINE DERIVATIVES AND THEIR THERAPEUTICAL USE DARWIN DISCOVERY LTD (GB) 2003-08-20 EP claimed