SCHEMBL16656153

SCHEMBL16656153

COc1cc(/C=C2/C(=O)OC/C2=C/c2ccc3c(c2)OCO3)cc(OC)c1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.54
KDM4E B2RXH2 5/20 0.51
ATM Q13315 3/20 0.51
MAPT P10636 11/20 0.50
ALDH1A1 P00352 9/20 0.50
KMT2A Q03164 5/20 0.50
TDP1 Q9NUW8 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
HPGD P15428 2/20 0.50
MAPK1 P28482 2/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
PKM P14618 1/20 0.50
XBP1 P17861 1/20 0.50
PAX8 Q06710 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
LY96 Q9Y6Y9 1/20 0.50
POLB P06746 1/20 0.50
GAA P10253 1/20 0.50
HTT P42858 1/20 0.49

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
SCHEMBL16656152 0.87 DYRK1A (0.62) KDM4EMAPTALDH1A1KMT2ATDP1
SCHEMBL31237283 0.87 DYRK1A (0.62) KDM4EMAPTALDH1A1KMT2ATDP1
SCHEMBL29577825 0.87 DYRK1A (0.62) KDM4EMAPTALDH1A1KMT2ATDP1
SCHEMBL13642454 0.84 ATM (0.57) MAOBKDM4EATMMAPTALDH1A1
SCHEMBL13642233 0.77 DYRK1A (0.61) KDM4EMAPTALDH1A1KMT2ATDP1
SCHEMBL7008830 0.76 KDM4E (0.57) MAOBKDM4EATMMAPTALDH1A1
SCHEMBL7005392 0.75 ALDH1A1 (0.60) KDM4EMAPTALDH1A1KMT2ATDP1
SCHEMBL14070054 0.73 MAPT (0.58) KDM4EMAPTALDH1A1KMT2ATDP1
SCHEMBL7006167 0.72 ALDH1A1 (0.47) MAOBKDM4EMAPTALDH1A1KMT2A
SCHEMBL7008510 0.70 MAPT (0.71) KDM4EATMMAPTALDH1A1KMT2A

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
US-9011925-B2 Method for preparing polysaccharide nanocomposite particles and uses of the same CHINA MEDICAL UNIVERSITY (TW) 2015-04-21 US disclosed