Juglone

Juglone

SCHEMBL8903905

C=CCOCC=C.O=C1C=CC(=O)c2c(O)cccc21

nearest known ligand 0.67

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 5/20 0.67
▸ ALDH1A1 P00352 4/20 0.67
▸ KDM4E B2RXH2 4/20 0.67
▸ RECQL P46063 4/20 0.67
▸ TOP1 P11387 3/20 0.67
▸ AURKA O14965 3/20 0.67
▸ CDC25B P30305 3/20 0.67
▸ AURKB Q96GD4 3/20 0.67
▸ HPGD P15428 3/20 0.67
▸ ALOX15 P16050 3/20 0.67
▸ MAPK1 P28482 3/20 0.67
▸ HSD17B10 Q99714 3/20 0.67
▸ TDP1 Q9NUW8 3/20 0.67
▸ KMT2A Q03164 3/20 0.67
▸ MEN1 O00255 2/20 0.67
▸ TRPA1 O75762 2/20 0.67
▸ TP53 P04637 2/20 0.67
▸ P4HB P07237 2/20 0.67
▸ CYP3A4 P08684 2/20 0.67
▸ CASP1 P29466 2/20 0.67

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
Juglone SCHEMBL8908716 0.98 MAPT (0.65) MAPTALDH1A1KDM4ERECQLTOP1
Juglone SCHEMBL9280529 0.82 MAPT (1.00) MAPTALDH1A1KDM4ERECQLTOP1
Juglone SCHEMBL34185 0.82 MAPT (1.00) MAPTALDH1A1KDM4ERECQLTOP1
Juglone SCHEMBL29500185 0.82 MAPT (1.00) MAPTALDH1A1KDM4ERECQLTOP1
Juglone SCHEMBL17888856 0.80 MAPT (0.96) MAPTALDH1A1KDM4ERECQLTOP1
Juglone SCHEMBL9476381 0.79 MAPT (0.85) MAPTALDH1A1KDM4ERECQLTOP1
Juglone SCHEMBL14246054 0.78 MAPT (0.92) MAPTALDH1A1KDM4ERECQLTOP1
Juglone SCHEMBL25330089 0.77 MAPT (0.81) MAPTALDH1A1KDM4ERECQLTOP1
Juglone SCHEMBL2720570 0.75 MAPT (0.85) MAPTALDH1A1KDM4ERECQLTOP1
Anthraquinone SCHEMBL14245036 0.75 MAPT (0.85) MAPTALDH1A1KDM4ERECQLTOP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5200513-A Processes for producing doxorubicin, daunomycinone, and derivatives of doxorubicin BOARD OF REGENTS, UNIVERSITY OF NEBRASKA-LINCOLN (US) 1993-04-06 — — US claimed
US-5594158-A Processes for producing doxorubicin, daunomycinone, and derivatives of doxorubicin THE BOARD OF REGENTS OF THE UNIVERSITY OF NEBRASKA (US) 1997-01-14 — — US disclosed
US-5200513-A Processes for producing doxorubicin, daunomycinone, and derivatives of doxorubicin BOARD OF REGENTS, UNIVERSITY OF NEBRASKA-LINCOLN (US) 1993-04-06 — — US disclosed
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