SCHEMBL2568006

SCHEMBL2568006

CCCOc1ccc(C(=O)NC(C)(C)C(=O)O)cc1-c1nc(CC)c(CC)c(=O)[nH]1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.63
PDE6C P51160 2/20 0.55
PDE11A Q9HCR9 2/20 0.55
PDE1A P54750 1/20 0.55
PDE1B Q01064 1/20 0.55
PDE1C Q14123 1/20 0.55
HDAC1 Q13547 1/20 0.47

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
SCHEMBL2567521 0.92 PDE5A (0.66) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL17888962 0.91 PDE5A (0.61) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL17888947 0.91 PDE5A (0.61) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL17888953 0.88 PDE5A (0.58) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2568284 0.87 PDE5A (0.58) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2560389 0.86 PDE5A (0.72) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL17888957 0.86 PDE5A (0.64) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2563181 0.86 PDE5A (0.62) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2562786 0.85 PDE5A (0.62) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2565019 0.84 PDE5A (0.61) 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 5 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 claimed
US-8871777-B2 Phenylpyrimidone compounds, the pharmaceutical compositions, preparation methods and uses thereof TOPHARMAN SHANGHAI CO., LTD. (CN) 2014-10-28 US claimed
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
EP-2383262-A1 PHENYL PYRIMIDONE COMPOUNDS, PHARMACEUTICAL COMPOSITIONS, PREPARATION METHODS AND USES THEREOF Topharman Shanghai Co., Ltd. (CN) 2011-11-02 EP disclosed