SCHEMBL3853014

SCHEMBL3853014

CN1/C(=C/c2c(O)c(=O)c2=O)C(C)(C)c2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 11/20 0.55
HTT P42858 8/20 0.55
MAPT P10636 11/20 0.51
KDM4E B2RXH2 7/20 0.51
ALDH1A1 P00352 5/20 0.51
TSHR P16473 3/20 0.51
CASP1 P29466 2/20 0.51
HSD17B10 Q99714 2/20 0.51
MEN1 O00255 10/20 0.50
KMT2A Q03164 10/20 0.50
MAPK1 P28482 4/20 0.50
USP2 O75604 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
THRB P10828 3/20 0.49
RECQL P46063 3/20 0.49
SMN1; SMN2 Q16637 5/20 0.48
GAA P10253 3/20 0.48
POLB P06746 2/20 0.48
CRHBP P24387 1/20 0.48

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
SCHEMBL3853022 1.00 LMNA (0.55) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL5522293 0.86 MAPT (0.52) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL14453270 0.86 MAPT (0.52) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL12156970 0.84 MAPT (0.47) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL14769839 0.84 ALDH1A1 (0.47) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL14093786 0.83 LMNA (0.55) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL15947424 0.83 MAPT (0.47) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL16319609 0.83 MAPT (0.48) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL14769832 0.83 MAPT (0.48) LMNAHTTMAPTKDM4EALDH1A1
SCHEMBL17627872 0.82 LMNA (0.54) LMNAHTTMAPTKDM4EALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2362884-B1 A DYE COMPRISING A CHROMOPHORE TO WHICH AN ACYLOIN GROUP IS ATTACHED SONY CORP (JP) 2017-08-02 EP disclosed
US-9679702-B2 Dye comprising a chromophore to which an acyloin group is attached SONY CORPORATION (JP) 2017-06-13 US disclosed
US-8378120-B2 Method and reagent for measuring nitroreductase enzyme activity GE HEALTHCARE UK LIMITED (GB) 2013-02-19 US disclosed
US-20110265878-A1 DYE COMPRISING A CHROMOPHORE TO WHICH AN ACYLOIN GROUP IS ATTACHED SONY CORPORATION (JP) 2011-11-03 US disclosed
US-20090325209-A1 METHOD AND REAGENT FOR MEASURING NITROREDUCTASE ENZYME ACTIVITY GE HEALTHCARE UK LIMITED (GB) 2009-12-31 US disclosed
US-7579140-B2 Method and reagent for measuring nitroreductase enzyme activity GE HEALTHCARE UK LIMITED (GB) 2009-08-25 US disclosed
US-20080317674-A1 Method and Reagent for Measuring Nitroreductase Enzyme Activity GE HEALTHCARE UK LIMITED (GB) 2008-12-25 US disclosed
US-20070196767-A1 Use Of Squaric Acid Dyes In Optical Layers For Optical Data Recording CLARIANT INTERNATIONAL LTD (CH) 2007-08-23 US disclosed
US-20070196767-A1 Use Of Squaric Acid Dyes In Optical Layers For Optical Data Recording CLARIANT INTERNATIONAL LTD (CH) 2007-08-23 US disclosed
EP-1165693-A2 SQUARAINE DYES Amersham Pharmacia Biotech UK Limited (GB) 2002-01-02 EP disclosed
WO-2000058405-A2 SQUARAINE DYES AMERSHAM PHARMACIA BIOTECH UK LIMITED (GB) 2000-10-05 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090325209-A1 METHOD AND REAGENT FOR MEASURING NITROREDUCTASE ENZYME ACTIVITY CBR3, CBR1, ADH7 LMNA 3842/4885HTT 4799/4885MAPT 4857/4885
US-20080317674-A1 Method and Reagent for Measuring Nitroreductase Enzyme Activity CBR3, CBR1, SQOR LMNA 3803/4885HTT 4796/4885MAPT 4851/4885
US-20110265878-A1 DYE COMPRISING A CHROMOPHORE TO WHICH AN ACYLOIN GROUP IS ATTACHED ACOT7, ABHD5, MBOAT4 LMNA 970/4885HTT 1647/4885MAPT 3297/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.