SCHEMBL7306199

SCHEMBL7306199

CCCOc1ccc(NS(C)(=O)=O)cc1-c1nc2c(c(C)nn2CC)c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 1.00
PDE6D O43924 1/20 0.59
PDE6A P16499 1/20 0.59
PDE6G P18545 1/20 0.59
PDE6B P35913 1/20 0.59
PDE6C P51160 1/20 0.59
PDE6H Q13956 1/20 0.59

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
SCHEMBL7305370 0.93 PDE5A (0.87) PDE5A
SCHEMBL29612098 0.90 PDE5A (1.00) PDE5A
SCHEMBL719596 0.90 PDE5A (1.00) PDE5A
SCHEMBL7367964 0.88 PDE5A (0.79) PDE5A
SCHEMBL7302290 0.86 PDE5A (1.00) PDE5A
SCHEMBL7299038 0.84 PDE5A (0.80) PDE5A
SCHEMBL7307193 0.83 PDE5A (1.00) PDE5A
SCHEMBL7306664 0.83 PDE5A (0.79) PDE5A
SCHEMBL7298995 0.83 PDE5A (0.86) PDE5A
SCHEMBL7302417 0.82 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-0636626-A1 Pyrazolopyrimidine Derivatives LABORATOIRES GLAXO SA (FR) 1995-02-01 EP disclosed