SCHEMBL7302881

SCHEMBL7302881

CCCOc1ccc(NC(N)=S)cc1-c1nc2c(c(C)nn2C)c(=O)[nH]1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 1.00

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
SCHEMBL7299280 0.92 PDE5A (1.00) PDE5A
SCHEMBL7304176 0.90 PDE5A (1.00) PDE5A
SCHEMBL5595109 0.90 PDE5A (1.00) PDE5A
SCHEMBL7305399 0.89 PDE5A (1.00) PDE5A
SCHEMBL7305152 0.89 PDE5A (1.00) PDE5A
SCHEMBL7327556 0.88 PDE5A (0.80) PDE5A
SCHEMBL7303386 0.88 PDE5A (0.84) PDE5A
SCHEMBL7305303 0.88 PDE5A (0.89) PDE5A
SCHEMBL7305281 0.87 PDE5A (1.00) PDE5A
SCHEMBL7307889 0.87 PDE5A (0.77) 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