SCHEMBL7300325

SCHEMBL7300325

CCCOc1ccc([N+](=O)[O-])cc1-c1nc2c(c(C)nn2Cc2ccccc2)c(=O)[nH]1

nearest known ligand 0.81

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 20/20 0.81

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
SCHEMBL7305204 0.90 PDE5A (1.00) PDE5A
SCHEMBL7299809 0.86 PDE5A (1.00) PDE5A
SCHEMBL7299048 0.85 PDE5A (1.00) PDE5A
SCHEMBL7299536 0.83 PDE5A (0.86) PDE5A
SCHEMBL7302334 0.80 PDE5A (0.88) PDE5A
SCHEMBL7305962 0.78 PDE5A (0.86) PDE5A
SCHEMBL7296916 0.78 PDE5A (0.83) PDE5A
SCHEMBL7299038 0.76 PDE5A (0.80) PDE5A
SCHEMBL7348770 0.76 PDE5A (1.00) PDE5A
SCHEMBL7307193 0.75 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