SCHEMBL2564767

SCHEMBL2564767

CCCOc1ccc(C(=O)NCc2ccccn2)cc1-c1nc(CC)c(CC)c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 16/20 0.59
▸ PDE6C P51160 2/20 0.51
▸ PDE11A Q9HCR9 2/20 0.51
▸ PDE1A P54750 1/20 0.51
▸ PDE1B Q01064 1/20 0.51
▸ PDE1C Q14123 1/20 0.51
▸ TLR9 Q9NR96 1/20 0.49
▸ TLR8 Q9NR97 1/20 0.49
▸ TLR7 Q9NYK1 1/20 0.49
▸ HPGD P15428 1/20 0.48
▸ HSD17B10 Q99714 1/20 0.48
▸ NPC1 O15118 1/20 0.45
▸ RAB9A P51151 1/20 0.45
▸ ROCK2 O75116 1/20 0.45
▸ ROCK1 Q13464 1/20 0.45

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
SCHEMBL2567882 0.86 PDE5A (0.59) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL17888957 0.84 PDE5A (0.64) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2567375 0.84 PDE5A (0.68) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2566045 0.84 PDE5A (0.63) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2559566 0.83 PDE5A (0.62) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2565794 0.83 PDE5A (0.63) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2567521 0.82 PDE5A (0.66) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2565019 0.82 PDE5A (0.61) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2565050 0.81 PDE5A (0.61) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL2563968 0.81 PDE5A (0.60) 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 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 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
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
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