SCHEMBL7366877

SCHEMBL7366877

COc1ccc(C2CC(=O)N(Cc3ccc(NC(C)=O)cc3N)C2)cc1OC1CCCC1

nearest known ligand 0.64

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 15/20 0.64
PDE4A P27815 10/20 0.64
PDE4C Q08493 5/20 0.64
PDE4D Q08499 5/20 0.64

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
SCHEMBL27529144 0.91 PDE4A (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL7360680 0.91 PDE4A (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL7357991 0.88 PDE4A (0.57) PDE4BPDE4APDE4CPDE4D
SCHEMBL7363970 0.88 PDE4B (0.74) PDE4BPDE4APDE4CPDE4D
SCHEMBL7369367 0.88 PDE4B (0.74) PDE4BPDE4APDE4CPDE4D
SCHEMBL7360725 0.88 PDE4B (0.74) PDE4BPDE4APDE4CPDE4D
SCHEMBL7365291 0.87 PDE4B (0.69) PDE4BPDE4APDE4CPDE4D
SCHEMBL7364244 0.86 PDE4A (0.78) PDE4BPDE4APDE4CPDE4D
SCHEMBL27388868 0.86 PDE4A (0.78) PDE4BPDE4APDE4CPDE4D
SCHEMBL7367712 0.85 PDE4A (0.73) PDE4BPDE4APDE4CPDE4D

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
WO-1992019594-A1 PYRROLIDINONES SMITHKLINE BEECHAM CORPORATION (US) 1992-11-12 WO disclosed