SCHEMBL8240709

SCHEMBL8240709

CCc1nn(CCOC)c2c(Nc3cc(C)ccn3)nc(N)nc12

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.61
KCNH2 Q12809 1/20 0.55

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
SCHEMBL4038689 0.89 PDE5A (0.61) PDE5AKCNH2
SCHEMBL12768599 0.88 PDE5A (0.64) PDE5AKCNH2
SCHEMBL8234630 0.82 PDE5A (0.86) PDE5AKCNH2
SCHEMBL12768816 0.82 PDE5A (0.58) PDE5AKCNH2
SCHEMBL4045737 0.82 PDE5A (0.58) PDE5AKCNH2
SCHEMBL13815834 0.82 PDE5A (0.75) PDE5AKCNH2
SCHEMBL8242978 0.81 PDE5A (0.74) PDE5AKCNH2
SCHEMBL4040505 0.80 PDE5A (0.57) PDE5AKCNH2
SCHEMBL1527784 0.80 PDE5A (0.72) PDE5AKCNH2
SCHEMBL12768669 0.79 PDE5A (0.43) PDE5A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007054778-A1 PYRAZOLO[4,3-D]PYRIMIDIN-5-YL)DERIVATIVE USED AS PDE5 INHIBITORS PFIZER PRODUCTS INC. (US) 2007-05-18 WO disclosed