SCHEMBL5592932

SCHEMBL5592932

COc1ccc(-c2nc(CC(=O)Cc3ccccc3OCCF)co2)cc1OCC(C)C

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 2/20 0.41
DCK P27707 6/20 0.37
MAPT P10636 2/20 0.36
LMNA P02545 1/20 0.36
FPR2 P25090 2/20 0.35
HDAC1 Q13547 1/20 0.35
HDAC2 Q92769 1/20 0.35
HDAC8 Q9BY41 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
KMT2A Q03164 2/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
USP2 O75604 1/20 0.34
ALDH1A1 P00352 1/20 0.34
NPY2R P49146 1/20 0.34
HSD17B10 Q99714 1/20 0.34
GAA P10253 1/20 0.34
TSHR P16473 1/20 0.34

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
SCHEMBL4639772 0.88 DCK (0.37) DCKMAPTLMNAFPR2HDAC1
SCHEMBL5592687 0.87 FPR2 (0.37) MAPTLMNAFPR2KMT2AKDM4E
SCHEMBL4639814 0.85 KDM4E (0.41) MAPTLMNAKMT2AKDM4EMEN1
SCHEMBL5592984 0.84 LMNA (0.36) DHODHMAPTLMNAKMT2AKDM4E
SCHEMBL4639422 0.84 SMN1; SMN2 (0.42) MAPTLMNAFPR2KDM4EUSP2
SCHEMBL4280381 0.83 DHODH (0.43) DHODHMAPTFPR2
SCHEMBL4641012 0.83 TSHR (0.41) MAPTLMNAHDAC1HDAC8HDAC6
SCHEMBL4640424 0.81 KDM4E (0.39) MAPTLMNAKMT2AKDM4EMEN1
SCHEMBL4641121 0.81 KDM4E (0.42) MAPTLMNAKMT2AKDM4EMEN1
SCHEMBL4640577 0.81 KDM4E (0.39) MAPTLMNAKMT2AKDM4EMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007058338-A9 OXAZOLE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMA CO LTD (JP) 2007-11-01 WO disclosed