SCHEMBL4726094

SCHEMBL4726094

COc1ccc(CNc2ncnc3c(CCO)c(OC)c(NC(C)=O)cc23)cc1Cl

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE11A Q9HCR9 13/20 1.00
PDE4A P27815 1/20 0.71
PDE4B Q07343 1/20 0.71
PDE4C Q08493 1/20 0.71
PDE4D Q08499 1/20 0.71

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
SCHEMBL4725997 0.93 PDE11A (1.00) PDE11APDE4APDE4BPDE4CPDE4D
SCHEMBL4728772 0.93 PDE11A (1.00) PDE11APDE4APDE4BPDE4CPDE4D
SCHEMBL1934888 0.92 PDE11A (1.00) PDE11APDE4APDE4BPDE4CPDE4D
SCHEMBL4780617 0.91 PDE11A (1.00) PDE11APDE4APDE4BPDE4CPDE4D
SCHEMBL4794511 0.90 PDE11A (0.81) PDE11APDE4APDE4BPDE4CPDE4D
SCHEMBL4782778 0.89 PDE11A (0.80) PDE11A
SCHEMBL4725888 0.89 PDE11A (0.79) PDE11APDE4APDE4BPDE4CPDE4D
SCHEMBL4726801 0.88 PDE11A (0.85) PDE11A
SCHEMBL4725754 0.88 PDE11A (0.91) PDE11A
SCHEMBL4729771 0.87 PDE11A (0.78) PDE11APDE4APDE4BPDE4CPDE4D

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008020711-A1 QUINAZOLINE DERIVATIVE AS PHOSPHODIESTERASE INHIBITOR AND A PROCESS FOR PREPARING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2008-02-21 WO claimed
WO-2008020711-A1 QUINAZOLINE DERIVATIVE AS PHOSPHODIESTERASE INHIBITOR AND A PROCESS FOR PREPARING THE SAME CHONG KUN DANG PHARMACEUTICAL CORP. (KR) 2008-02-21 WO disclosed