SCHEMBL10062328

SCHEMBL10062328

C=C(C)C(=O)NCCCNC(=O)C(N)CCCCN

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GNAI3 P08754 1/20 0.64
GNAO1 P09471 1/20 0.64
GNAI1 P63096 1/20 0.64
DPP7 Q9UHL4 3/20 0.53
RRM1 P23921 1/20 0.51
TERT O14746 5/20 0.45
SIRT6 Q8N6T7 1/20 0.45
SIRT1 Q96EB6 1/20 0.45
GSR P00390 1/20 0.43
NOS1 P29475 1/20 0.43
MMP2 P08253 1/20 0.43
DPP8 Q6V1X1 1/20 0.43
DPP9 Q86TI2 1/20 0.43
PAOX Q6QHF9 2/20 0.42
TLR2 O60603 2/20 0.41

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
SCHEMBL13044202 0.90 GNAI3 (0.56) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL12829586 0.87 GNAI3 (0.75) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5502061 0.87 GNAI3 (0.75) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL16185923 0.86 GNAI3 (0.69) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL13044149 0.86 DPP7 (0.47) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5497787 0.85 GNAI3 (0.73) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL14845859 0.85 DPP7 (0.55) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL26224675 0.85 DPP7 (0.69) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5501940 0.84 GNAI3 (0.75) GNAI3GNAO1GNAI1DPP7RRM1
SCHEMBL5016309 0.83 GNAI3 (0.49) GNAI3GNAO1GNAI1DPP7RRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2222686-B1 POLYVIOLOGEN BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS MEDTRONIC MINIMED INC (US) 2015-06-17 EP disclosed
US-8658795-B2 Pyridinium boronic acid quenchers for use in analyte sensors GLUMETRICS, INC. (US) 2014-02-25 US disclosed
US-20120208286-A1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS, INC. (US) 2012-08-16 US disclosed
US-8178676-B2 Pyridinium boronic acid quenchers for use in analyte sensors GLUMETRICS, INC. (US) 2012-05-15 US disclosed
US-20110171742-A1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS, INC. (US) 2011-07-14 US disclosed
US-7939664-B2 Pyridinium boronic acid quenchers for use in analyte sensors GLUMETRICS INC. (US) 2011-05-10 US disclosed
US-7939664-B2 Pyridinium boronic acid quenchers for use in analyte sensors GLUMETRICS INC. (US) 2011-05-10 US disclosed
EP-2147003-B1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS INC (US) 2011-04-20 EP disclosed
US-7829341-B2 Polyviologen boronic acid quenchers for use in analyte sensors GLUMETRICS, INC. (US) 2010-11-09 US disclosed
US-7829341-B2 Polyviologen boronic acid quenchers for use in analyte sensors GLUMETRICS, INC. (US) 2010-11-09 US disclosed
US-20090081803-A1 POLYVIOLOGEN BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS INC. (US) 2009-03-26 US disclosed
US-20090081803-A1 POLYVIOLOGEN BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS INC. (US) 2009-03-26 US disclosed
WO-2009009756-A2 POLYVIOLOGEN BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS, INC. (US) 2009-01-15 WO disclosed
US-20080305009-A1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS INC. (US) 2008-12-11 US disclosed
US-20080305009-A1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS INC. (US) 2008-12-11 US disclosed
WO-2008137604-A1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS GLUMETRICS, INC. (US) 2008-11-13 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 (4 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-20120208286-A1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS BLVRB, PDXK, PNPO GNAI3 833/4885GNAO1 492/4885GNAI1 859/4885
US-20090081803-A1 POLYVIOLOGEN BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS SLC2A4, SLC2A2, SLC2A1 GNAI3 625/4885GNAO1 1177/4885GNAI1 694/4885
US-20080305009-A1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS BLVRB, PDXK, PNPO GNAI3 833/4885GNAO1 492/4885GNAI1 859/4885
US-20110171742-A1 PYRIDINIUM BORONIC ACID QUENCHERS FOR USE IN ANALYTE SENSORS BLVRB, PDXK, PNPO GNAI3 833/4885GNAO1 492/4885GNAI1 859/4885

“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.