SCHEMBL3247411

SCHEMBL3247411

NCCCCCCNC(=O)C1CCCCC1

nearest known ligand 0.79

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 1/20 0.70
KEAP1 Q14145 1/20 0.56
NFE2L2 Q16236 1/20 0.56
ITGB3 P05106 2/20 0.52
ITGA2B P08514 2/20 0.52
GNAI3 P08754 2/20 0.51
GNAO1 P09471 2/20 0.51
GNAI1 P63096 2/20 0.51
CHRNB2 P17787 5/20 0.51
CHRNB4 P30926 5/20 0.51
CHRNA3 P32297 5/20 0.51
CHRNA4 P43681 5/20 0.51
GRIN1 Q05586 2/20 0.51
GRIN2A Q12879 2/20 0.51
GRM1 Q13255 2/20 0.51
EPHX1 P07099 1/20 0.50
NAMPT P43490 1/20 0.50
PAOX Q6QHF9 2/20 0.48
GRIA1 P42261 1/20 0.47

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
SCHEMBL22170865 1.00 NAAA (0.70) NAAAKEAP1NFE2L2ITGB3ITGA2B
SCHEMBL8355467 0.98 NAAA (0.67) NAAAKEAP1NFE2L2ITGB3ITGA2B
SCHEMBL19630921 0.98 NAAA (0.67) NAAAKEAP1NFE2L2ITGB3ITGA2B
SCHEMBL13300769 0.93 NAAA (0.64) NAAAKEAP1NFE2L2ITGB3ITGA2B
SCHEMBL16357639 0.91 NAAA (0.61) NAAAKEAP1NFE2L2ITGB3ITGA2B
SCHEMBL17172545 0.91 NAAA (0.82) NAAAKEAP1NFE2L2GNAI3GNAO1
SCHEMBL13432005 0.87 NAAA (0.56) NAAAKEAP1NFE2L2ITGB3ITGA2B
Hydrochloric Acid SCHEMBL1285234 0.85 NAAA (0.54) NAAAKEAP1NFE2L2ITGB3ITGA2B
SCHEMBL23419143 0.85 NAAA (0.58) NAAAKEAP1NFE2L2ITGB3ITGA2B
SCHEMBL61158 0.85 NAAA (0.58) NAAAKEAP1NFE2L2ITGB3ITGA2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1490359-B1 DETECTION OF GLUCOSE IN SOLUTIONS ALSO CONTAINING AN ALPHA-HYDROXY ACID OR A BETA-DIKETONE SENSORS FOR MED & SCIENCE INC (US) 2010-05-19 EP disclosed
EP-1490359-A4 DETECTION OF GLUCOSE IN SOLUTIONS ALSO CONTAINING AN ALPHA-HYDROXY ACID OR A BETA-DIKETONE SENSORS FOR MED & SCIENCE INC (US) 2006-08-23 EP disclosed
US-7078554-B2 Detection of glucose in solutions also containing an alpha-hydroxy acid or a beta-diketone SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2006-07-18 US disclosed
US-20050043275-A1 Detection of glucose in solutions also containing an alpha-hydroxy acid or a beta-diketone SENSEONICS, INCORPORATED 2005-02-24 US disclosed
EP-1490359-A1 DETECTION OF GLUCOSE IN SOLUTIONS ALSO CONTAINING AN ALPHA-HYDROXY ACID OR A BETA-DIKETONE Sensors for Medicine and Science, Inc. (US) 2004-12-29 EP disclosed
US-6800451-B2 MORE STABLE REACTION OF GLUCOSE WITH A BORONIC ACID COMPOUND SUCH AS 9,10-BISN-(BORONOBENZYL)-N-(3-(METHYACRYLAMIDO) PROPYLAMINO)METHYLANTHRACENE SENSORS FOR MEDICINE AND SCIENCE, INC. 2004-10-05 US disclosed
WO-2003078424-A1 DETECTION OF GLUCOSE IN SOLUTIONS ALSO CONTAINING AN ALPHA-HYDROXY ACID OR A BETA-DIKETONE SENSORS FOR MEDICINE AND SCIENCE, INC. (US) 2003-09-25 WO disclosed
US-20030082663-A1 Detection of glucose in solutions also containing an alpha-hydroxy acid or a beta-diketone SENSORS FOR MEDICINE AND SCIENCE, INC. 2003-05-01 US 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-20050043275-A1 Detection of glucose in solutions also containing an alpha-hydroxy acid or a beta-diketone GCK, KHK, HK1 NAAA 2540/4885KEAP1 973/4885NFE2L2 1843/4885

“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.