Anthraquinone

Anthraquinone

SCHEMBL28110120

CCCCOC(=O)O.O=C1c2ccccc2C(=O)c2ccccc21

nearest known ligand 0.55

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ELANE P08246 2/20 0.55
TSHR P16473 5/20 0.54
TDP1 Q9NUW8 2/20 0.54
L3MBTL1 Q9Y468 2/20 0.54
ALDH1A1 P00352 4/20 0.49
MAPK1 P28482 3/20 0.49
CYP3A4 P08684 2/20 0.49
TP53 P04637 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
PTPN1 P18031 1/20 0.48
HSD17B10 Q99714 1/20 0.47
LMNA P02545 4/20 0.47
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR4 P22455 1/20 0.46
FGFR3 P22607 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44

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
Anthraquinone SCHEMBL28110119 0.88 ELANE (0.64) ELANETSHRTDP1L3MBTL1ALDH1A1
Biphenyl SCHEMBL17473153 0.84 TSHR (0.59) TSHRTDP1L3MBTL1ALDH1A1MAPK1
Phenol SCHEMBL20876507 0.82 TSHR (0.59) TSHRTDP1L3MBTL1ALDH1A1MAPK1
Anthraquinone SCHEMBL11703673 0.81 TSHR (0.67) ELANETSHRTDP1L3MBTL1ALDH1A1
SCHEMBL28014164 0.80 TSHR (0.52) TSHRTDP1L3MBTL1ALDH1A1MAPK1
Acetophenone SCHEMBL28519002 0.79 LMNA (0.56) TSHRTDP1L3MBTL1ALDH1A1MAPK1
SCHEMBL110422 0.79
Biphenyl SCHEMBL17473071 0.79 TSHR (0.61) TSHRTDP1L3MBTL1ALDH1A1MAPK1
Benzoyl Peroxide SCHEMBL28876080 0.78 LMNA (0.59) TSHRTDP1L3MBTL1ALDH1A1MAPK1
Propiophenone SCHEMBL28515262 0.78 TSHR (0.53) TSHRTDP1L3MBTL1ALDH1A1MAPK1

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
CN-107003570-A Liquid crystal represents element 日产化学工业株式会社 2017-08-01 CN disclosed
CN-107003571-A Liquid crystal represents element 日产化学工业株式会社 2017-08-01 CN disclosed
CN-106462011-A Liquid crystal display element, liquid crystal alignment film, and liquid crystal alignment treatment agent 日产化学工业株式会社 2017-02-22 CN disclosed