SCHEMBL7364251

SCHEMBL7364251

COc1ccc(C2CC(=O)N(Cc3ccncc3NC(C)=O)C2)cc1OC1CCCC1

nearest known ligand 0.60

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 11/20 0.60
PDE4B Q07343 15/20 0.58
PDE4C Q08493 6/20 0.58
PDE4D Q08499 6/20 0.58

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
SCHEMBL7364245 1.00 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7364454 1.00 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7359066 0.94 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7359058 0.94 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7369011 0.94 PDE4A (0.60) PDE4APDE4BPDE4CPDE4D
SCHEMBL7367852 0.89 PDE4A (0.69) PDE4APDE4BPDE4CPDE4D
SCHEMBL7360680 0.87 PDE4A (0.62) PDE4APDE4BPDE4CPDE4D
SCHEMBL27529144 0.87 PDE4A (0.62) PDE4APDE4BPDE4CPDE4D
SCHEMBL7365291 0.86 PDE4B (0.69) PDE4APDE4BPDE4CPDE4D
SCHEMBL3543217 0.84 PDE4A (0.57) PDE4APDE4BPDE4CPDE4D

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1993007141-A1 HETEROCYCLIC 3-PHENYLPYRROLIDIN-2-ONES, THEIR PREPARATION AND USE FOR THE MANUFACTURE OF A MEDICAMENT FOR INHIBITING TUMOR NECROSIS FACTOR PRODUCTION SMITHKLINE BEECHAM CORPORATION (US) 1993-04-15 WO claimed
WO-1993007141-A1 HETEROCYCLIC 3-PHENYLPYRROLIDIN-2-ONES, THEIR PREPARATION AND USE FOR THE MANUFACTURE OF A MEDICAMENT FOR INHIBITING TUMOR NECROSIS FACTOR PRODUCTION SMITHKLINE BEECHAM CORPORATION (US) 1993-04-15 WO disclosed