Benzoquinone

Benzoquinone

SCHEMBL28824019

Cc1nc2ccccc2nc1C.O=C1C=CC(=O)C=C1

nearest known ligand 0.48

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.48
KDM4E B2RXH2 3/20 0.48
CYP1A2 P05177 3/20 0.48
ALDH1A1 P00352 3/20 0.48
GPR3 P46089 1/20 0.46
EGFR P00533 2/20 0.46
MAPK1 P28482 2/20 0.46
NPC1 O15118 1/20 0.46
HTT P42858 1/20 0.46
RAB9A P51151 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
NQO2 P16083 2/20 0.44
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
CASP3 P42574 1/20 0.43
HPGD P15428 2/20 0.42
GAA P10253 1/20 0.42
STAT3 P40763 1/20 0.42
NUDT1 P36639 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
SCHEMBL103601 0.84 MAPT (0.62) MAPTKDM4ECYP1A2ALDH1A1GPR3
SCHEMBL29364974 0.84 MAPT (0.62) MAPTKDM4ECYP1A2ALDH1A1GPR3
SCHEMBL11011451 0.82 MAPT (0.59) MAPTKDM4ECYP1A2ALDH1A1GPR3
Water SCHEMBL27864881 0.82 MAPT (0.59) MAPTKDM4ECYP1A2ALDH1A1GPR3
Ammonia Solution, Strong SCHEMBL27821564 0.82 MAPT (0.59) MAPTKDM4ECYP1A2ALDH1A1GPR3
Hydrochloric Acid SCHEMBL28590789 0.79 MAPT (0.56) MAPTKDM4ECYP1A2ALDH1A1GPR3
Formamide SCHEMBL28940988 0.76 MAPT (0.48) MAPTKDM4ECYP1A2ALDH1A1GPR3
SCHEMBL17652916 0.75 NQO2 (0.68) MAPTKDM4ECYP1A2ALDH1A1GPR3
SCHEMBL28228457 0.73 MAPT (0.56) MAPTKDM4ECYP1A2ALDH1A1GPR3
SCHEMBL13500415 0.72 MAPT (0.53) MAPTKDM4ECYP1A2ALDH1A1GPR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114927715-A Semisolid suspension flow battery electrolyte and preparation method and application thereof 深圳大学 2022-08-19 CN claimed
CN-114927715-B Semisolid suspension flow battery electrolyte and preparation method and application thereof 深圳大学 2022-11-11 CN disclosed
CN-114927715-B Semisolid suspension flow battery electrolyte and preparation method and application thereof 深圳大学 2022-11-11 CN disclosed
CN-114927715-A Semisolid suspension flow battery electrolyte and preparation method and application thereof 深圳大学 2022-08-19 CN disclosed
CN-114927715-A Semisolid suspension flow battery electrolyte and preparation method and application thereof 深圳大学 2022-08-19 CN disclosed