SCHEMBL4639690

SCHEMBL4639690

COc1ccc(-c2nc(CC(=O)Cc3ccccc3OC)co2)cc1O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
KDM4E B2RXH2 5/20 0.43
HSD17B10 Q99714 5/20 0.43
ALDH1A1 P00352 4/20 0.43
USP2 O75604 3/20 0.43
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
NPY2R P49146 1/20 0.43
TTR P02766 1/20 0.41
LMNA P02545 3/20 0.41
HPGD P15428 2/20 0.41
MAPK1 P28482 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
ATM Q13315 1/20 0.41
NPC1 O15118 1/20 0.41
HCRTR1 O43613 1/20 0.41
TP53 P04637 1/20 0.41
BLM P54132 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
P2RY14 Q15391 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
SCHEMBL4639483 0.93 KDM4E (0.44) MAPTKDM4EHSD17B10ALDH1A1USP2
SCHEMBL4639475 0.92 KDM4E (0.38) MAPTKDM4EHSD17B10ALDH1A1USP2
SCHEMBL4640544 0.92 PIK3CG (0.42) MAPTKDM4EHSD17B10ALDH1A1USP2
SCHEMBL4639429 0.91 KDM4E (0.37) MAPTKDM4EHSD17B10ALDH1A1USP2
SCHEMBL4640424 0.84 KDM4E (0.39) MAPTKDM4EHSD17B10ALDH1A1USP2
SCHEMBL4640577 0.83 KDM4E (0.39) MAPTKDM4EHSD17B10ALDH1A1USP2
SCHEMBL4640423 0.83 PDE4A (0.43) MAPTKDM4EHSD17B10ALDH1A1USP2
SCHEMBL4641365 0.82 LMNA (0.38) MAPTKDM4EHSD17B10USP2KMT2A
SCHEMBL4639629 0.81 PARP1 (0.44) MAPTKDM4EHSD17B10ALDH1A1USP2
SCHEMBL4639574 0.81 MAPT (0.37) MAPTKDM4EHSD17B10USP2LMNA

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