Benzoquinone

Benzoquinone

SCHEMBL8053003

CCC(O)N(c1ccc(C)cc1)C(O)CC.O=C1C=CC(=O)C=C1

nearest known ligand 0.34

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MMP2 P08253 2/20 0.34
MMP9 P14780 2/20 0.34
ALDH1A1 P00352 2/20 0.33
TSHR P16473 1/20 0.33
RAB9A P51151 2/20 0.33
POLB P06746 1/20 0.32
ATM Q13315 1/20 0.31
LMNA P02545 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
KEAP1 Q14145 1/20 0.31
NFE2L2 Q16236 1/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31
SLC6A4 P31645 1/20 0.31

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
SCHEMBL146242 0.89 ALDH1A1 (0.41) MEN1KMT2AMMP2MMP9ALDH1A1
Hydroquinone SCHEMBL8038441 0.82 ACHE (0.48) MEN1KMT2AMMP2MMP9ALDH1A1
SCHEMBL4603382 0.76 ALDH1A1 (0.44) MEN1KMT2AMMP2MMP9ALDH1A1
SCHEMBL4352146 0.72 ALDH1A1 (0.44) MEN1KMT2AALDH1A1TSHRRAB9A
SCHEMBL3619964 0.71 ALDH1A1 (0.47) MEN1KMT2AALDH1A1TSHRRAB9A
SCHEMBL147287 0.71 PDE5A (0.37) ALDH1A1TSHRRAB9AHTT
SCHEMBL1408150 0.71 LMNA (0.46) MEN1KMT2AALDH1A1TSHRPOLB
SCHEMBL1136297 0.70 CA1 (0.54) MEN1KMT2AALDH1A1RAB9APOLB
SCHEMBL11122139 0.70 HTT (0.36) ALDH1A1HTT
P-Xylene SCHEMBL28011603 0.69 ACHE (0.57) ALDH1A1POLBLMNASMN1; SMN2

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-6015845-A Binder for building structure ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 2000-01-18 US disclosed