SCHEMBL7002163

SCHEMBL7002163

CCCOc1ccc(S(=O)(=O)N2CCN(C)CC2)cc1-c1nc2c(C(N)=O)nn(Cc3ccccn3)c2c(=O)[nH]1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.64
PDE6C P51160 2/20 0.55
PDE11A Q9HCR9 2/20 0.55
PDE2A O00408 1/20 0.54
ABCC4 O15439 1/20 0.54
ABCC5 O15440 1/20 0.54
PDE6D O43924 1/20 0.54
PDE8A O60658 1/20 0.54
PDE9A O76083 1/20 0.54
ABCB11 O95342 1/20 0.54
CYP3A4 P08684 1/20 0.54
HTR1A P08908 1/20 0.54
PDE6A P16499 1/20 0.54
PDE6G P18545 1/20 0.54
PDE4A P27815 1/20 0.54
ADORA2A P29274 1/20 0.54
ADORA1 P30542 1/20 0.54
ADRA1A P35348 1/20 0.54
PDE6B P35913 1/20 0.54
PDE1A P54750 1/20 0.54

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
Hydrochloric Acid SCHEMBL7002986 0.86 PDE5A (0.67) PDE5APDE6CPDE11APDE2AABCC4
SCHEMBL6995161 0.86 PDE5A (0.61) PDE5APDE6CPDE11APDE2AABCC4
SCHEMBL7002214 0.84 PDE5A (0.66) PDE5APDE6C
SCHEMBL6340439 0.84 PDE5A (0.88) PDE5APDE6CPDE11A
SCHEMBL6333001 0.84 PDE5A (0.80) PDE5APDE6CPDE11APDE2AABCC4
SCHEMBL5079364 0.83 PDE5A (0.79) PDE5APDE6CPDE11A
SCHEMBL5595608 0.83 PDE5A (0.69) PDE5APDE6CPDE11APDE2AABCC4
SCHEMBL6330329 0.82 PDE5A (0.66) PDE5APDE6CPDE11APDE2AABCC4
SCHEMBL6197841 0.82 PDE5A (0.71) PDE5APDE6CPDE11APDE1APDE1B
SCHEMBL6198388 0.82 PDE5A (0.64) 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
EP-1123296-B1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LTD (GB) 2003-09-17 EP disclosed
US-6333330-B1 Pyrazolopyrimidinone CGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. 2001-12-25 US disclosed
EP-1123296-A1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION Pfizer Limited (GB) 2001-08-16 EP disclosed
WO-2000024745-A1 PYRAZOLOPYRIMIDINONE cGMP PDE5 INHIBITORS FOR THE TREATMENT OF SEXUAL DYSFUNCTION PFIZER LIMITED (GB) 2000-05-04 WO disclosed