SCHEMBL8255337

SCHEMBL8255337

CCCOCCn1c(=O)c(NCCCNc2cccc(C)n2)nc2ncc(-c3ccc(OC)nc3)cc21

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PDE5A O76074 20/20 0.76
▸ PDE6A P16499 19/20 0.76

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
SCHEMBL8251927 0.97 PDE5A (0.75) PDE5APDE6A
SCHEMBL8255175 0.92 PDE5A (0.75) PDE5APDE6A
SCHEMBL8255183 0.91 PDE5A (0.76) PDE5APDE6A
SCHEMBL8245567 0.89 PDE5A (0.76) PDE5APDE6A
SCHEMBL8255242 0.89 PDE5A (0.78) PDE5APDE6A
SCHEMBL8253996 0.89 PDE5A (0.75) PDE5APDE6A
SCHEMBL8250742 0.89 PDE5A (0.74) PDE5APDE6A
SCHEMBL8254497 0.88 PDE5A (0.87) PDE5APDE6A
SCHEMBL8251736 0.88 PDE5A (0.76) PDE5APDE6A
SCHEMBL8254222 0.88 PDE5A (0.75) PDE5APDE6A

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-2006126081-A2 PYRIDINO [2 , 3-B] PYRAZINONES AS PDE-5 INHIBITORS PHARMACIA & UPJOHN COMPANY LLC (US) 2006-11-30 — — WO disclosed
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