SCHEMBL16313334

SCHEMBL16313334

CCN1C(=O)c2c(nc(C#Cc3ccccc3)n2Cc2cc(Cl)c(OC)c(Cl)c2)N2C[C@@H](Cc3ccccc3)NC12

nearest known ligand 0.52

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 20/20 0.52

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
SCHEMBL16298502 0.91 PDE5A (0.51) PDE5A
SCHEMBL8363069 0.79 PDE5A (0.84) PDE5A
SCHEMBL16313301 0.76 PDE5A (0.62) PDE5A
SCHEMBL16298501 0.73 PDE5A (0.46) PDE5A
SCHEMBL8363071 0.71 PDE5A (0.54) PDE5A
SCHEMBL8360081 0.68 PDE5A (0.83) PDE5A
SCHEMBL16312817 0.65 PDE5A (0.45) PDE5A
SCHEMBL14201493 0.62 PDE5A (0.58) PDE5A
SCHEMBL5075690 0.59 PDE5A (1.00) PDE5A
SCHEMBL8358726 0.58 PDE5A (1.00) 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
EP-1790652-A1 Polycyclic guanine phosphodiesterase V inhibitors Schering Corporation (US) 2007-05-30 — — EP disclosed
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