SCHEMBL4639480

SCHEMBL4639480

CCOc1ccccc1CC(=O)Cc1coc(-c2ccc(OC)c(OCC3CC3)c2)n1

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.41
PDE4B Q07343 4/20 0.41
PDE4C Q08493 1/20 0.41
PDE4D Q08499 1/20 0.41
LMNA P02545 2/20 0.40
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
HSD17B10 Q99714 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
FPR2 P25090 2/20 0.39
TSHR P16473 1/20 0.38
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
S1PR1 P21453 1/20 0.38
S1PR3 Q99500 1/20 0.38
POLB P06746 1/20 0.37

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
SCHEMBL4640423 0.95 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL4639868 0.93 PDE4A (0.43) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL4639383 0.90 PDE4D (0.42) PDE4APDE4BPDE4CPDE4D
SCHEMBL4639471 0.90 PDE4B (0.40) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL4640557 0.90 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL4639456 0.89 PDE4A (0.40) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL4639422 0.88 SMN1; SMN2 (0.42) LMNAMAPTKDM4EUSP2HSD17B10
SCHEMBL4640052 0.87 KDM4E (0.46) LMNAKDM4EHSD17B10S1PR1S1PR3
SCHEMBL4276916 0.87 SMN1; SMN2 (0.41) PDE4APDE4BPDE4CPDE4DLMNA
SCHEMBL4641238 0.85 LMNA (0.41) LMNAMAPTKDM4EUSP2HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1954684-A2 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION Otsuka Pharmaceutical Co., Ltd. (JP) 2008-08-13 EP disclosed
WO-2007058338-A9 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMA CO LTD (JP) 2007-11-01 WO disclosed
WO-2007058338-A2 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2007-05-24 WO disclosed