Benzoquinone

Benzoquinone

SCHEMBL10607259

O=C1C=CC(=O)C=C1.O=C1c2ccccc2C(=O)c2c(F)c(F)c(F)c(F)c21

nearest known ligand 0.46

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Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 8/20 0.46
KMT2A Q03164 8/20 0.46
CDC25B P30305 1/20 0.46
MAOA P21397 7/20 0.45
MAPT P10636 7/20 0.45
ADORA2A P29274 3/20 0.45
CSNK1A1 P48729 2/20 0.45
CSNK1D P48730 2/20 0.45
CSNK1G1 Q9HCP0 2/20 0.45
FGR P09769 1/20 0.45
PIM1 P11309 1/20 0.45
DYRK1A Q13627 1/20 0.45
HIPK2 Q9H2X6 1/20 0.45
KDM4E B2RXH2 4/20 0.44
MAPK1 P28482 4/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
RECQL P46063 3/20 0.44
POLB P06746 3/20 0.44
APAF1 O14727 2/20 0.44
TDP2 O95551 2/20 0.44

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
SCHEMBL6650819 0.91 MEN1 (0.55) MEN1KMT2ACDC25BMAOAMAPT
Anthraquinone SCHEMBL9174151 0.78 MEN1 (0.75) MEN1KMT2ACDC25BMAOAMAPT
SCHEMBL9445872 0.77 MEN1 (0.44) MEN1KMT2ACDC25BMAOAMAPT
Benzoquinone SCHEMBL28580648 0.72 MAOA (0.59) MEN1KMT2ACDC25BMAOAMAPT
SCHEMBL29378153 0.72 TTR (0.50) MEN1KMT2ACDC25BMAOAMAPT
SCHEMBL23199114 0.72 TTR (0.50) MEN1KMT2ACDC25BMAOAMAPT
SCHEMBL3418850 0.72 MEN1 (0.55) MEN1KMT2ACDC25BMAOAMAPT
SCHEMBL10607286 0.71 IDO1 (0.52) MEN1KMT2ACDC25BMAOAMAPT
SCHEMBL31307459 0.71 CA1 (0.43) MEN1KMT2AMAOAMAPTADORA2A
SCHEMBL3417192 0.71 TTR (0.53) MEN1KMT2ACDC25BMAOAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0170190-B1 METHOD FOR PRODUCTION OF FLUORINATED QUINONES Nippon Shokubai Kagaku Kogyo Co., Ltd (JP) 1989-12-06 EP claimed
US-4689179-A FLUORINATION OF CHLORINATED ANHYDRIDES OR QUINONES; CROWN ETHER CATALYST, PHASE TRANSFER NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) 1987-08-25 US claimed
EP-0170190-A2 Method for production of fluorinated quinones Nippon Shokubai Kagaku Kogyo Co., Ltd (JP) 1986-02-05 EP claimed