SCHEMBL6882828

SCHEMBL6882828

O=C1NC(=O)c2c1c(B(O)O)cc1ccccc21

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.39
KDM4E B2RXH2 2/20 0.39
GAA P10253 1/20 0.39
CDK4 P11802 5/20 0.38
CCND1 P24385 5/20 0.38
PARP1 P09874 2/20 0.38
CDK5 Q00535 3/20 0.38
CDK5R1 Q15078 3/20 0.38
GSK3B P49841 3/20 0.38
GSK3A P49840 2/20 0.38
CCNB2 O95067 2/20 0.37
CCNE2 O96020 2/20 0.37
PRKCG P05129 2/20 0.37
PRKCB P05771 2/20 0.37
CDK1 P06493 2/20 0.37
CCNB1 P14635 2/20 0.37
PRKCA P17252 2/20 0.37
CCNE1 P24864 2/20 0.37
CDK2 P24941 2/20 0.37
CCNB3 Q8WWL7 2/20 0.37

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
SCHEMBL1889878 0.77 PARP1 (0.55) ALDH1A1KDM4EGAACDK4CCND1
SCHEMBL1756365 0.77 TRPM4 (0.48) CDK4CCND1CDK5CDK5R1GSK3B
SCHEMBL789452 0.76 TRPM4 (0.47) CDK4CCND1CDK5CDK5R1GSK3B
SCHEMBL3257584 0.74 ALDH1A1 (0.40) ALDH1A1KDM4EGAACDK4CCND1
SCHEMBL3852137 0.74 CDK4 (0.44) ALDH1A1KDM4EGAACDK4CCND1
SCHEMBL339346 0.74 GAA (0.41) ALDH1A1KDM4EGAACDK4CCND1
SCHEMBL6848266 0.74 CDK4 (0.42) ALDH1A1KDM4EGAACDK4CCND1
SCHEMBL11667133 0.73 CES1 (0.39) ALDH1A1CDK4CCND1CDK5CDK5R1
SCHEMBL11714771 0.73 ALDH1A1 (0.54) ALDH1A1KDM4EGAAMAPTHPGD
SCHEMBL8205630 0.72 CDK4 (0.40) KDM4ECDK4CCND1CDK5CDK5R1

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
WO-2023163965-A1 REACTIVE THIN FILM COATINGS ON CATALYST LIBRARIES FOR HIGH THROUGHPUT SCREENING NORTHWESTERN UNIVERSITY (US) 2023-08-31 WO claimed
WO-2023163965-A1 REACTIVE THIN FILM COATINGS ON CATALYST LIBRARIES FOR HIGH THROUGHPUT SCREENING NORTHWESTERN UNIVERSITY (US) 2023-08-31 WO disclosed
US-6682938-B1 USING COMPOUND HAVING SUBSTRATE-RECOGNITION COMPONENT, FLUORESCENCE ?SWITCH? MEDIATED BY SUBSTRATE RECOGNITION EVENT, AND FLUOROPHORE IN MOLECULE IN IMPLANTABLE SYSTEMS FOR CONTINUOUS TRANSDERMAL MONITORING OF BLOOD GLUCOSE LEVELS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-01-27 US disclosed
US-6673625-B2 NAPTHALIMIDE BORONATE DERIVATIVES AND SUBSTITUTED CHLOROBENZOPHENOXAZINONE BORONATE DERIVATIVES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-01-06 US disclosed
WO-2001075450-A9 FLUORESCENT LIFETIME ASSAYS FOR NON-INVASIVE QUANTIFICATION OF ANALYTES UNIV CALIFORNIA (US) 2002-12-19 WO disclosed
EP-1214596-A1 GLUCOSE SENSING MOLECULES HAVING SELECTED FLUORESCENT PROPERTIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2002-06-19 EP disclosed
US-20020043651-A1 Fluorescent lifetime assays for non-invasive quantification of analytes such as glucose ENERGY, U.S. DEPARTMENT OF 2002-04-18 US disclosed
US-20020010279-A1 Saccharide sensing molecules having enhanced fluorescent properties LAWRENCE LIVERMORE NATIONAL SECURITY LLC 2002-01-24 US disclosed
WO-2001075450-A2 FLUORESCENT LIFETIME ASSAYS FOR NON-INVASIVE QUANTIFICATION OF ANALYTES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-10-11 WO disclosed
WO-2001074968-A2 SACCHARIDE SENSING MOLECULES HAVING ENHANCED FLUORESCENT PROPERTIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-10-11 WO disclosed
WO-2001020334-A1 GLUCOSE SENSING MOLECULES HAVING SELECTED FLUORESCENT PROPERTIES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2001-03-22 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 (1 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-20020010279-A1 Saccharide sensing molecules having enhanced fluorescent properties SLC2A1, SLC2A9, SLC2A2 ALDH1A1 261/4885KDM4E 3240/4885GAA 79/4885

“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.