SCHEMBL2559792

SCHEMBL2559792

CCOc1ccccc1-c1nc(C(C)C)c(Br)c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GUSB P08236 1/20 0.59
PDE5A O76074 17/20 0.58
PDE6D O43924 2/20 0.54
PDE6A P16499 2/20 0.54
PDE6G P18545 2/20 0.54
PDE6B P35913 2/20 0.54
PDE6C P51160 2/20 0.54
PDE6H Q13956 2/20 0.54
PDE1A P54750 3/20 0.51
PDE1B Q01064 3/20 0.51
PDE1C Q14123 3/20 0.51
KDM4E B2RXH2 1/20 0.49

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
SCHEMBL2562540 0.91 PDE5A (0.66) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL2566057 0.90 PDE5A (0.60) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL16188257 0.88 PDE5A (0.61) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL2564939 0.86 GUSB (0.60) GUSBPDE5APDE1APDE1BPDE1C
SCHEMBL2567594 0.85 GUSB (0.59) GUSBPDE5APDE1APDE1BPDE1C
SCHEMBL2562186 0.85 GUSB (0.59) GUSBPDE5APDE1APDE1BPDE1C
SCHEMBL2565233 0.81 GUSB (0.62) GUSBPDE5APDE1APDE1BPDE1C
SCHEMBL2568080 0.80 GUSB (0.53) GUSBPDE5APDE1APDE1BPDE1C
SCHEMBL2564934 0.77 PDE5A (0.59) PDE5APDE6DPDE6APDE6GPDE6B
SCHEMBL2567731 0.77 PDE5A (0.61) GUSBPDE5APDE6DPDE6APDE6G

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2383262-B1 PHENYL PYRIMIDONE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHODS AND USES THEREOF TOPHARMAN SHANGHAI CO LTD (CN) 2016-07-06 EP disclosed
EP-2383262-B1 PHENYL PYRIMIDONE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHODS AND USES THEREOF TOPHARMAN SHANGHAI CO LTD (CN) 2016-07-06 EP 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
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
EP-2383262-A1 PHENYL PYRIMIDONE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHODS AND USES THEREOF Topharman Shanghai Co., Ltd. (CN) 2011-11-02 EP disclosed