SCHEMBL16972452

SCHEMBL16972452

CCCc1n[nH]c2c(=O)[nH]c(Cc3ccccc3OCC)nc12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE1A P54750 9/20 0.48
PDE1B Q01064 9/20 0.48
PDE1C Q14123 9/20 0.48
PDE9A O76083 5/20 0.48
PDE5A O76074 7/20 0.47
ALDH1A1 P00352 3/20 0.45
MEN1 O00255 2/20 0.45
HPGD P15428 2/20 0.45
KMT2A Q03164 2/20 0.45
AR P10275 1/20 0.41
GUSB P08236 1/20 0.38
ALOX15 P16050 2/20 0.37
PNP P00491 1/20 0.37
KDM4E B2RXH2 1/20 0.37
PDE2A O00408 1/20 0.37
PDE6D O43924 1/20 0.37
USP2 O75604 1/20 0.37
LMNA P02545 1/20 0.37
CYP1A2 P05177 1/20 0.37
MAPT P10636 1/20 0.37

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
SCHEMBL6365530 0.94 PDE1A (0.46) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL6372442 0.88 PDE1A (0.51) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL3494602 0.84 AR (0.48) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL6368321 0.84 PDE9A (0.59) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL6365996 0.83 PDE1A (0.57) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL1028 0.83 PDE5A (0.68) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL7360299 0.81 PDE5A (0.39) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL7085453 0.80 PDE5A (0.36) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL6374090 0.80 PDE1A (0.48) PDE1APDE1BPDE1CPDE9APDE5A
SCHEMBL8244420 0.78 PDE5A (0.45) PDE1APDE1BPDE1CPDE9APDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3099689-A1 PYRAZOLOPYRIMIDINONES FOR THE TREATMENT OF IMPOTENCE AND PROCESS FOR THE PREPARATION THEREOF Council of Scientific and Industrial Research (IN) 2016-12-07 EP disclosed
WO-2015114647-A1 PYRAZOLOPYRIMIDINONES FOR THE TREATMENT OF IMPOTENCE AND PROCESS FOR THE PREPARATION THEREOF COUNCIL OF SCIENTIFIC AND INDUSTRIAL RESEARCH (IN) 2015-08-06 WO disclosed