SCHEMBL28164522

SCHEMBL28164522

Cn1c2cc(O)ccc2c(=O)c2ccc(O)cc21

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.51
TTR P02766 1/20 0.46
MAPT P10636 2/20 0.45
KDM4E B2RXH2 2/20 0.45
ALDH1A1 P00352 2/20 0.45
HPGD P15428 2/20 0.45
HSD17B10 Q99714 2/20 0.45
THRB P10828 1/20 0.45
NPSR1 Q6W5P4 1/20 0.45
HTT P42858 2/20 0.43
L3MBTL1 Q9Y468 4/20 0.43
WEE1 P30291 1/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
TLR9 Q9NR96 1/20 0.43
EGFR P00533 1/20 0.42
SRC P12931 1/20 0.42
BCHE P06276 1/20 0.42
ACHE P22303 1/20 0.42
ESR1 P03372 1/20 0.42

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
SCHEMBL28278675 0.91 ATM (0.66) ATMMAPTKDM4EALDH1A1HPGD
SCHEMBL3886263 0.87 BCHE (0.52) TTRMAPTKDM4EALDH1A1HPGD
SCHEMBL3231588 0.84 ATM (0.50) ATMTTRMAPTKDM4EALDH1A1
SCHEMBL11378517 0.80 HTT (0.57) ATMMAPTKDM4EALDH1A1HPGD
SCHEMBL30777875 0.79 CYP2C9 (0.50) TTRMAPTKDM4EALDH1A1HPGD
SCHEMBL26768260 0.79 CYP2C9 (0.50) TTRMAPTKDM4EALDH1A1HPGD
SCHEMBL31087387 0.78 MGAM (0.51) MAPTKDM4EALDH1A1HPGDHTT
SCHEMBL13633649 0.78 L3MBTL1 (0.61) ATMMAPTKDM4EALDH1A1HPGD
SCHEMBL1538292 0.78 GPR3 (0.64) ATMMAPTKDM4EALDH1A1HPGD
SCHEMBL9869325 0.77 KDM4E (0.61) TTRMAPTKDM4EALDH1A1HPGD

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
CN-107056702-A A kind of ether derivative of acridone two and its production and use 复旦大学 2017-08-18 CN disclosed