SCHEMBL7016598

SCHEMBL7016598

CCc1cc2c(OC(=O)Nc3c(Cl)cc(C#N)cc3Cl)cnc(OC)c2o1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 14/20 0.67
PDE4B Q07343 14/20 0.67
PDE4C Q08493 14/20 0.67
PDE4D Q08499 14/20 0.67
PDE5A O76074 4/20 0.35
MALT1 Q9UDY8 1/20 0.33
CETP P11597 1/20 0.33

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
SCHEMBL7020449 0.95 PDE4A (0.76) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL7019337 0.90 PDE4D (0.55) PDE4APDE4BPDE4CPDE4DPDE5A
SCHEMBL7021594 0.89 PDE4D (0.59) PDE4APDE4BPDE4CPDE4D
SCHEMBL7019218 0.85 PDE4B (0.49) PDE4APDE4BPDE4CPDE4D
SCHEMBL7014555 0.81 PDE4A (0.75) PDE4APDE4BPDE4CPDE4D
SCHEMBL7020430 0.80 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7020796 0.80 PDE4B (0.50) PDE4APDE4BPDE4CPDE4D
SCHEMBL7019362 0.80 PDE4A (0.48) PDE4APDE4BPDE4CPDE4D
SCHEMBL7018517 0.79 PDE4D (0.72) PDE4APDE4BPDE4CPDE4D
SCHEMBL7016945 0.79 PDE4A (0.52) PDE4APDE4BPDE4CPDE4DMALT1

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