Anthraquinone

Anthraquinone

SCHEMBL28111282

O=C(c1cccc2c1Cc1ccccc1S2)c1cccc2c1Cc1ccccc1S2.O=C1c2ccccc2C(=O)c2ccccc21

nearest known ligand 0.51

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.51
HPGD P15428 3/20 0.51
KDM4E B2RXH2 3/20 0.51
MEN1 O00255 5/20 0.43
KMT2A Q03164 5/20 0.43
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.41
MAOA P21397 1/20 0.41
MAPT P10636 3/20 0.40
HTT P42858 1/20 0.40
ATM Q13315 1/20 0.40
PTGS2 P35354 1/20 0.40
OPRK1 P41145 1/20 0.40
PDE4D Q08499 1/20 0.40
KEAP1 Q14145 2/20 0.40
NFE2L2 Q16236 1/20 0.40
HTR7 P34969 1/20 0.39
HTR2B P41595 1/20 0.39
BLM P54132 1/20 0.38
SMN1; SMN2 Q16637 2/20 0.37

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
SCHEMBL1470487 0.91 ALDH1A1 (0.47) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL28225011 0.89 ALDH1A1 (0.42) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL28229795 0.89 MEN1 (0.53) ALDH1A1HPGDKDM4EMEN1KMT2A
Tectoquinone SCHEMBL28835696 0.89 ALDH1A1 (0.53) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL28130613 0.88 ALDH1A1 (0.52) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL5903677 0.86 ALDH1A1 (0.44) ALDH1A1HPGDKDM4EMEN1KMT2A
Benzophenone SCHEMBL28087563 0.85 ALDH1A1 (0.44) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL7556216 0.81 TRPA1 (0.49) ALDH1A1HPGDKDM4EMEN1KMT2A
Anthraquinone SCHEMBL27538046 0.81 ALDH1A1 (0.69) ALDH1A1HPGDKDM4EMEN1KMT2A
SCHEMBL27296099 0.80 TRPA1 (0.50) ALDH1A1HPGDKDM4EMEN1KMT2A

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-106132655-A The color manufactured for addition process and/or the liquid radiation curable resins of transparency change 帝斯曼知识产权资产管理有限公司 2016-11-16 CN disclosed