Anthraquinone

Anthraquinone

SCHEMBL28295557

CC(C)c1cccc2c(=O)c3ccccc3sc12.O=C1c2ccccc2C(=O)c2ccccc21

nearest known ligand 0.56

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
ALDH1A1 P00352 3/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
LMNA P02545 2/20 0.43
POLB P06746 2/20 0.43
HCRTR1 O43613 1/20 0.43
CYP19A1 P11511 1/20 0.40
KDM4E B2RXH2 4/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
DPP4 P27487 1/20 0.38
NR1H2 P55055 1/20 0.38
NR1H3 Q13133 1/20 0.38
PARP14 Q460N5 1/20 0.38
SLC9A1 P19634 2/20 0.36
PABPC1 P11940 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35

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
SCHEMBL29398001 0.94 MAPT (0.48) MAPTALDH1A1L3MBTL1LMNAPOLB
SCHEMBL108905 0.94 MAPT (0.48) MAPTALDH1A1L3MBTL1LMNAPOLB
Cycloheptane SCHEMBL23089052 0.90 MAPT (0.44) MAPTALDH1A1L3MBTL1LMNAPOLB
Propionaldehyde SCHEMBL8326892 0.85 CYP19A1 (0.43) MAPTALDH1A1L3MBTL1LMNAPOLB
SCHEMBL1821428 0.81 KDM4E (0.68) MAPTALDH1A1L3MBTL1LMNAPOLB
SCHEMBL1102404 0.81 GPR3 (0.48) MAPTALDH1A1L3MBTL1LMNAKDM4E
Anthraquinone SCHEMBL3693137 0.79 KDM4E (0.56) MAPTALDH1A1L3MBTL1LMNAPOLB
SCHEMBL3205462 0.78 KDM4E (0.46) MAPTALDH1A1L3MBTL1LMNAPOLB
SCHEMBL2397412 0.78 ALDH1A1 (0.37) MAPTALDH1A1L3MBTL1LMNAPOLB
SCHEMBL8595006 0.77 KDM4E (0.55) MAPTALDH1A1L3MBTL1LMNAPOLB

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-109679402-A A kind of filling perforation filling special jack printing ink composition and printed circuit board 深圳市容大感光科技股份有限公司 2019-04-26 CN disclosed