SCHEMBL4639991

SCHEMBL4639991

CCOc1ccccc1CC(=O)Cc1coc(-c2ccc(OC)c(OCCCc3ccccc3)c2)n1

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.46
PDE4B Q07343 4/20 0.46
PDE4C Q08493 4/20 0.46
PDE4D Q08499 4/20 0.46
POLB P06746 1/20 0.45
LMNA P02545 2/20 0.41
MAPK1 P28482 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MTNR1B P49286 1/20 0.40
KDM4E B2RXH2 1/20 0.40
USP2 O75604 1/20 0.40
MAPT P10636 1/20 0.40
HSD17B10 Q99714 1/20 0.40
TP53 P04637 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL4641227 0.96 POLB (0.46) PDE4APDE4BPDE4CPDE4DPOLB
SCHEMBL4639422 0.91 SMN1; SMN2 (0.42) POLBLMNAKDM4EUSP2MAPT
SCHEMBL4640052 0.87 KDM4E (0.46) LMNAMAPK1KDM4EHSD17B10
SCHEMBL4641207 0.86 KDM4E (0.43) POLBLMNAMAPK1L3MBTL1KDM4E
SCHEMBL4641238 0.85 LMNA (0.41) POLBLMNAKDM4EUSP2MAPT
SCHEMBL4639814 0.85 KDM4E (0.41) POLBLMNAKDM4EUSP2MAPT
SCHEMBL4639873 0.85 LMNA (0.41) POLBLMNAKDM4EUSP2MAPT
SCHEMBL4641121 0.84 KDM4E (0.42) POLBLMNAKDM4EUSP2MAPT
SCHEMBL4639483 0.84 KDM4E (0.44) LMNAMAPK1KDM4EUSP2MAPT
SCHEMBL4639396 0.84 SMN1; SMN2 (0.44) POLBLMNAMAPK1KDM4EUSP2

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