SCHEMBL7016377

SCHEMBL7016377

CCc1cc2c(NCc3ccc(OC)c(Cl)c3)nc(N3CCC(OC(=O)O)CC3)nc2s1

nearest known ligand 0.47

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 15/20 0.47

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
SCHEMBL7015416 0.93 ACHE (0.41) PDE5A
SCHEMBL7013978 0.92 PDE4A (0.43) PDE5A
SCHEMBL7016974 0.92 PDE5A (0.46) PDE5A
SCHEMBL7019437 0.92 PDE5A (0.49) PDE5A
SCHEMBL8178906 0.91 PDE5A (0.54) PDE5A
SCHEMBL7016738 0.91 PDE5A (0.48) PDE5A
SCHEMBL7016530 0.90 PDE5A (0.47) PDE5A
SCHEMBL8183512 0.88 PDE5A (0.47) PDE5A
SCHEMBL7011361 0.87 PDE5A (0.49) PDE5A
SCHEMBL7021735 0.86 HRH4 (0.47)

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 3 patents. 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
EP-0934321-A1 THIENOPYRIMIDINE WITH PHOSPHODIESTERASE V INHIBITING EFFECT MERCK PATENT GmbH (DE) 1999-08-11 EP disclosed
WO-1998017668-A1 THIENOPYRIMIDINE WITH PHOSPHODIESTERASE V INHIBITING EFFECT MERCK PATENT GMBH (DE) 1998-04-30 WO disclosed