Benzoquinone

Benzoquinone

SCHEMBL9318388

O=C1C=CC(=O)C=C1.O=S(=O)(O)CCS(=O)(=O)O

nearest known ligand 0.47

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

DRD2

The experimentally established mechanism targets of Benzoquinone. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BLM P54132 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
ALDH1A1 P00352 1/20 0.47
BCHE P06276 1/20 0.47
POLB P06746 1/20 0.47
MAOA P21397 1/20 0.47
ACHE P22303 1/20 0.47
MAOB P27338 1/20 0.47
APEX1 P27695 1/20 0.47
MAPK1 P28482 1/20 0.47
CASP1 P29466 1/20 0.47
RECQL P46063 1/20 0.47
MDM2 Q00987 1/20 0.47
DHODH Q02127 1/20 0.47
HSD17B10 Q99714 1/20 0.47
APOBEC3G Q9HC16 1/20 0.47
PTGS1 P23219 1/20 0.41
PDE4A P27815 1/20 0.41
LMNA P02545 1/20 0.41
SLC6A6 P31641 1/20 0.41

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
Benzoquinone SCHEMBL4943047 0.81 TDP1 (0.61) BLMTDP1ALDH1A1BCHEPOLB
Benzoquinone SCHEMBL27939443 0.81 TDP1 (0.61) BLMTDP1ALDH1A1BCHEPOLB
Benzoquinone SCHEMBL27730092 0.81 TDP1 (0.61) BLMTDP1ALDH1A1BCHEPOLB
Benzoquinone SCHEMBL3238193 0.81 TDP1 (0.61) BLMTDP1ALDH1A1BCHEPOLB
Benzoquinone SCHEMBL28528775 0.78 TDP1 (0.57) BLMTDP1ALDH1A1BCHEPOLB
Benzoquinone SCHEMBL27878726 0.78 TDP1 (0.57) BLMTDP1ALDH1A1BCHEPOLB
Benzoquinone SCHEMBL27390105 0.78 TDP1 (0.57) BLMTDP1ALDH1A1BCHEPOLB
SCHEMBL2622 0.77 PTGS1 (0.60) BLMTDP1ALDH1A1APEX1PTGS1
SCHEMBL21777928 0.77 PTGS1 (0.60) BLMTDP1ALDH1A1APEX1PTGS1
Benzoquinone SCHEMBL8035204 0.75 TDP1 (0.53) BLMTDP1ALDH1A1BCHEPOLB

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
US-5324815-A Polyaniline NITTO DENKO CORPORATION (JP) 1994-06-28 US disclosed