SCHEMBL5196428

SCHEMBL5196428

COc1ccc(C2CC(=O)N(CC(=O)Nc3c(C)cccc3C)C2)cc1OC1CCCO1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 10/20 0.49
PDE4A P27815 12/20 0.47
SMN1; SMN2 Q16637 1/20 0.45
PDE4C Q08493 8/20 0.44
PDE4D Q08499 8/20 0.44
RXFP1 Q9HBX9 1/20 0.44
TP53 P04637 1/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
HPGD P15428 1/20 0.41
HTT P42858 1/20 0.41

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
SCHEMBL3549580 1.00 PDE4B (0.49) PDE4BPDE4ASMN1; SMN2PDE4CPDE4D
SCHEMBL5246847 0.89 TP53 (0.56) PDE4BPDE4ASMN1; SMN2PDE4CPDE4D
SCHEMBL3551575 0.88 SMN1; SMN2 (0.49) PDE4BPDE4ASMN1; SMN2PDE4CPDE4D
SCHEMBL3552383 0.88 PDE4A (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL3546863 0.88 PDE4A (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL3544153 0.88 PDE4A (0.62) PDE4BPDE4APDE4CPDE4D
SCHEMBL3550263 0.87 PDE4A (0.47) PDE4BPDE4ASMN1; SMN2PDE4CPDE4D
SCHEMBL3551471 0.87 MAPT (0.49) PDE4BPDE4ASMN1; SMN2PDE4CPDE4D
SCHEMBL3547020 0.87 SMN1; SMN2 (0.47) PDE4BPDE4ASMN1; SMN2PDE4CPDE4D
SCHEMBL3555029 0.87 SMN1; SMN2 (0.47) PDE4BPDE4ASMN1; SMN2PDE4CPDE4D

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
EP-1802615-A1 PHOSPHODIESTERASE 4 INHIBITORS Memory Pharmaceuticals Corporation (US) 2007-07-04 EP disclosed
WO-2006044955-A1 PHOSPHODIESTERASE 4 INHIBITORS MEMORY PHARMACEUTICALS CORPORATION (US) 2006-04-27 WO disclosed