SCHEMBL11067436

SCHEMBL11067436

CC1CC(=O)Nc2cccc(OCCCC(=O)N(CCO)C3CCCCC3)c21

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE3B Q13370 19/20 0.47
PDE3A Q14432 19/20 0.47
PDE4A P27815 1/20 0.42
PDE4B Q07343 1/20 0.42
PDE4C Q08493 1/20 0.42
PDE4D Q08499 1/20 0.42
P2RY12 Q9H244 3/20 0.40
PDE2A O00408 2/20 0.40

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
SCHEMBL11071217 0.84 PDE3B (0.48) PDE3BPDE3AP2RY12
SCHEMBL11067928 0.84 PDE3B (0.48) PDE3BPDE3AP2RY12
SCHEMBL11061924 0.82 PDE3B (0.56) PDE3BPDE3AP2RY12PDE2A
SCHEMBL11068086 0.79 PDE3B (0.42) PDE3BPDE3A
SCHEMBL11058328 0.79 PDE3B (0.49) PDE3BPDE3AP2RY12
SCHEMBL11064304 0.79 PDE3B (0.46) PDE3BPDE3AP2RY12PDE2A
SCHEMBL11069955 0.79 PDE3B (0.50) PDE3BPDE3A
SCHEMBL11062523 0.77 PDE3B (0.49) PDE3BPDE3APDE4APDE4BPDE4C
SCHEMBL11063314 0.76 PDE3B (0.55) PDE3BPDE3AP2RY12PDE2A
SCHEMBL11071596 0.76 PDE3B (0.41) PDE3BPDE3A

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
US-4435404-A ANTICOAGULANTS OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1984-03-06 US disclosed