SCHEMBL2564571

SCHEMBL2564571

CCCOc1ccccc1-c1nc(CC)c(CC)c(=O)[nH]1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.71
PDE6C P51160 2/20 0.61
PDE11A Q9HCR9 2/20 0.61
KDM4E B2RXH2 1/20 0.61
MEN1 O00255 1/20 0.61
PDE2A O00408 1/20 0.61
PDE6D O43924 1/20 0.61
USP2 O75604 1/20 0.61
PDE9A O76083 1/20 0.61
ALDH1A1 P00352 1/20 0.61
LMNA P02545 1/20 0.61
CYP1A2 P05177 1/20 0.61
MAPT P10636 1/20 0.61
HPGD P15428 1/20 0.61
ALOX15 P16050 1/20 0.61
PDE6A P16499 1/20 0.61
PDE6G P18545 1/20 0.61
PDE4A P27815 1/20 0.61
PDE6B P35913 1/20 0.61
PDE1A P54750 1/20 0.61

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
SCHEMBL2566251 0.89 PDE5A (0.58) PDE5APDE6CPDE11AKDM4EMEN1
SCHEMBL2569806 0.88 PDE5A (0.61) PDE5APDE6CPDE11AKDM4EMEN1
SCHEMBL2563339 0.86 PDE5A (0.60) PDE5APDE6CPDE11AKDM4EMEN1
SCHEMBL2565276 0.84 PDE5A (0.78) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2567867 0.83 PDE5A (0.76) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2565095 0.83 PDE5A (0.76) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2569020 0.83 PDE5A (1.00) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL17888964 0.83 PDE5A (0.66) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL21985859 0.82 PDE5A (0.78) PDE5APDE6CPDE11APDE6DPDE6A
SCHEMBL16198832 0.82 PDE5A (0.73) PDE5APDE6CPDE11APDE1APDE1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8871777-B2 Phenylpyrimidone compounds, the pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO., LTD. (CN) 2014-10-28 US disclosed
US-8871777-B2 Phenylpyrimidone compounds, the pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO., LTD. (CN) 2014-10-28 US disclosed
US-8871777-B2 Phenylpyrimidone compounds, the pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO., LTD. (CN) 2014-10-28 US disclosed
EP-2383262-A1 PHENYL PYRIMIDONE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHODS AND USES THEREOF Topharman Shanghai Co., Ltd. (CN) 2011-11-02 EP disclosed