SCHEMBL7020191

SCHEMBL7020191

COc1ccc(CNc2nc(N3CCC(OC(=O)O)CC3)nc3sc(C)c(C)c23)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 13/20 0.48

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
SCHEMBL7018507 0.95 PDE5A (0.48) PDE5A
SCHEMBL7015293 0.93 TP53 (0.41) PDE5A
SCHEMBL7020121 0.92 GAA (0.41) PDE5A
SCHEMBL7017441 0.92 PDE5A (0.46) PDE5A
SCHEMBL8181196 0.91 PDE5A (0.52) PDE5A
SCHEMBL7019915 0.89 PDE5A (0.42) PDE5A
SCHEMBL7015450 0.88 PDE5A (0.48) PDE5A
SCHEMBL7017615 0.87 PDE5A (0.46) PDE5A
SCHEMBL7017130 0.87 PDE5A (0.46) PDE5A
SCHEMBL8187992 0.87 PDE5A (0.47) 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-0934321-B1 THIENOPYRIMIDINE WITH PHOSPHODIESTERASE V INHIBITING EFFECT MERCK PATENT GMBH (DE) 2003-08-06 EP disclosed