Benzoquinone

Benzoquinone

SCHEMBL28499021

Nc1ccccc1N.O=C1C=CC(=O)C=C1

nearest known ligand 0.62

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 4/20 0.62
CASP1 P29466 2/20 0.62
ALOX15 P16050 2/20 0.62
CASP7 P55210 1/20 0.62
SMN1; SMN2 Q16637 1/20 0.62
ALDH1A1 P00352 5/20 0.50
HSD17B10 Q99714 4/20 0.50
TDP1 Q9NUW8 3/20 0.50
MAOA P21397 3/20 0.50
APOBEC3G Q9HC16 2/20 0.50
MAOB P27338 2/20 0.50
BCHE P06276 1/20 0.50
POLB P06746 1/20 0.50
ACHE P22303 1/20 0.50
APEX1 P27695 1/20 0.50
MAPK1 P28482 1/20 0.50
RECQL P46063 1/20 0.50
BLM P54132 1/20 0.50
MDM2 Q00987 1/20 0.50
DHODH Q02127 1/20 0.50

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
Questiomycin B SCHEMBL11060308 0.82 ALOX15 (0.71) CYP3A4CASP1ALOX15CASP7SMN1; SMN2
SCHEMBL29351116 0.79
SCHEMBL5167521 0.79 CYP3A4 (1.00) CYP3A4CASP1ALOX15CASP7SMN1; SMN2
SCHEMBL6187 0.79
Benzoquinone SCHEMBL22041970 0.79 TSHR (0.65) CYP3A4CASP1ALDH1A1HSD17B10TDP1
Benzoquinone SCHEMBL9225792 0.76 JAK2 (0.53) CYP3A4CASP1ALOX15CASP7SMN1; SMN2
SCHEMBL29186433 0.76 CYP3A4 (0.77) CYP3A4CASP1ALOX15CASP7SMN1; SMN2
Bromide SCHEMBL7413670 0.75 CYP3A4 (0.91) CYP3A4CASP1ALOX15CASP7SMN1; SMN2
Methane SCHEMBL21408528 0.75
Fluoride SCHEMBL859274 0.75 CYP3A4 (0.91) CYP3A4CASP1ALOX15CASP7SMN1; 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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111943208-B Method for preparing titanium carbide (MXene) flexible electrode based on high-temperature carbonization of polymer and application of method 中山大学 2022-04-01 CN claimed
CN-111943208-A Method for preparing titanium carbide (MXene) flexible electrode based on high-temperature carbonization of polymer and application of method 中山大学 2020-11-17 CN claimed
CN-111943208-B Method for preparing titanium carbide (MXene) flexible electrode based on high-temperature carbonization of polymer and application of method 中山大学 2022-04-01 CN disclosed
CN-111943208-B Method for preparing titanium carbide (MXene) flexible electrode based on high-temperature carbonization of polymer and application of method 中山大学 2022-04-01 CN disclosed
CN-111943208-A Method for preparing titanium carbide (MXene) flexible electrode based on high-temperature carbonization of polymer and application of method 中山大学 2020-11-17 CN disclosed
CN-111943208-A Method for preparing titanium carbide (MXene) flexible electrode based on high-temperature carbonization of polymer and application of method 中山大学 2020-11-17 CN disclosed