SCHEMBL16229852

SCHEMBL16229852

COc1ccc(CNc2c(F)cnc3ccc(C#N)cc23)cc1Cl

nearest known ligand 0.76

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.76
PDE6C P51160 2/20 0.57
PDE6D O43924 1/20 0.55
PDE6A P16499 1/20 0.55
PDE6G P18545 1/20 0.55
PDE6B P35913 1/20 0.55
PDE6H Q13956 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
SCHEMBL4990471 0.87 PDE5A (0.84) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL4994864 0.87 PDE5A (0.83) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL4989397 0.87 PDE5A (1.00) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL6853469 0.86 PDE5A (0.75) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL5595728 0.85 PDE5A (0.80) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL5595570 0.85 PDE5A (0.80) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL4983571 0.85 PDE5A (0.81) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL5595604 0.84 PDE5A (0.79) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL4989622 0.84 PDE5A (0.80) PDE5APDE6CPDE6DPDE6APDE6G
SCHEMBL5595920 0.84 PDE5A (0.75) PDE5APDE6CPDE6DPDE6APDE6G

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-2379076-B1 PHOSPHODIESTERASE INHIBITORS AND USES THEREOF UNIV COLUMBIA (US) 2014-11-12 EP disclosed