SCHEMBL2365288

SCHEMBL2365288

Fc1ccccc1Cn1nc(-c2ncc(N3CCOCC3)cn2)c2cccnc21

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 17/20 0.50
ADORA3 P0DMS8 1/20 0.49
KCNH2 Q12809 1/20 0.49
GUCY1B2 O75343 1/20 0.44
GUCY1A2 P33402 1/20 0.44
GUCY1A1 Q02108 1/20 0.44
GUCY1B1 Q02153 1/20 0.44

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
SCHEMBL417331 0.84 ADORA3 (0.60) PDE5AADORA3KCNH2GUCY1A1GUCY1B1
SCHEMBL5777076 0.84 PDE5A (0.48) PDE5AADORA3KCNH2
SCHEMBL29382996 0.84 ADORA3 (0.60) PDE5AADORA3KCNH2GUCY1A1GUCY1B1
SCHEMBL5777620 0.84 PDE5A (0.52) PDE5AADORA3KCNH2
SCHEMBL5775598 0.83 PDE5A (0.49) PDE5AADORA3KCNH2GUCY1A1GUCY1B1
SCHEMBL5779816 0.83 PDE5A (0.49) PDE5AADORA3KCNH2GUCY1A1GUCY1B1
SCHEMBL18496415 0.83 PDE5A (0.59) PDE5AADORA3KCNH2
SCHEMBL5775370 0.81 PDE5A (0.56) PDE5AADORA3KCNH2
SCHEMBL5777230 0.81 ADORA3 (0.51) PDE5AADORA3KCNH2
SCHEMBL15087585 0.80 ADORA3 (0.58) PDE5AADORA3KCNH2GUCY1A1GUCY1B1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2531187-A1 sGC STIMULATORS OR sGC ACTIVATORS ALONE AND IN COMBINATION WITH PDE5 INHBITORS FOR THE TREATMENT OF CYSTIC FIBROSIS Bayer Intellectual Property GmbH (DE) 2012-12-12 EP claimed
WO-2011095534-A1 sGC STIMULATORS OR sGC ACTIVATORS ALONE AND IN COMBINATION WITH PDE5 INHBITORS FOR THE TREATMENT OF CYSTIC FIBROSIS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-08-11 WO claimed
EP-3525779-A1 COMBINATION CONTAINING SGC STIMULATORS AND MINERALOCORTICOID RECEPTOR ANTAGONISTS Bayer Pharma Aktiengesellschaft (DE) 2019-08-21 EP disclosed
EP-2531187-A1 sGC STIMULATORS OR sGC ACTIVATORS ALONE AND IN COMBINATION WITH PDE5 INHBITORS FOR THE TREATMENT OF CYSTIC FIBROSIS Bayer Intellectual Property GmbH (DE) 2012-12-12 EP disclosed
WO-2011095534-A1 sGC STIMULATORS OR sGC ACTIVATORS ALONE AND IN COMBINATION WITH PDE5 INHBITORS FOR THE TREATMENT OF CYSTIC FIBROSIS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-08-11 WO disclosed