SCHEMBL6773144

SCHEMBL6773144

CCCOc1ncc(I)cc1-c1nc2c(CC)n(CC(=O)O)nc2c(=O)[nH]1

nearest known ligand 0.59

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.59
PDE6C P51160 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
SCHEMBL6777157 0.85 PDE5A (0.46) PDE5APDE6C
SCHEMBL6777036 0.83 PDE5A (0.62) PDE5APDE6C
SCHEMBL6363509 0.83 PDE5A (0.66) PDE5APDE6C
SCHEMBL2405922 0.82 PDE5A (0.69) PDE5APDE6C
SCHEMBL6630947 0.81 PDE5A (0.68) PDE5APDE6C
SCHEMBL6358551 0.81 PDE5A (0.69) PDE5APDE6C
SCHEMBL6776801 0.79 PDE5A (0.79) PDE5APDE6C
SCHEMBL6777960 0.78 PDE5A (0.58) PDE5A
SCHEMBL6778148 0.78 PDE5A (0.69) PDE5APDE6C
SCHEMBL8490684 0.77 PDE5A (0.64) PDE5APDE6C

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
US-6756373-B1 SUCH AS 5-(2-BUTOXY-5-IODO-3-PYRIDINYL)-3-ETHYL-2-(2-METHOXY-ETHYL)-2,6-DIHYDRO-7H -PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE; CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS; ERECTILE DYSFUNCTION PFIZER INC. 2004-06-29 US claimed
US-6756373-B1 SUCH AS 5-(2-BUTOXY-5-IODO-3-PYRIDINYL)-3-ETHYL-2-(2-METHOXY-ETHYL)-2,6-DIHYDRO-7H -PYRAZOLO(4,3-D)PYRIMIDIN-7-ONE; CYCLIC GUANOSINE 3',5'-MONOPHOSPHATE PHOSPHODIESTERASE INHIBITORS; ERECTILE DYSFUNCTION PFIZER INC. 2004-06-29 US disclosed