SCHEMBL13092015

SCHEMBL13092015

OB(O)c1cccc(C[n+]2ccc(-c3cc[n+](Cc4cccc(B(O)O)c4)cc3)cc2)c1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 4/20 0.55
CHKA P35790 7/20 0.50
MGLL Q99685 1/20 0.47
LPL P06858 2/20 0.46
LIPG Q9Y5X9 2/20 0.46
BCHE P06276 2/20 0.44
ACHE P22303 2/20 0.44
KDM4E B2RXH2 2/20 0.44
ALDH1A1 P00352 2/20 0.44
RAB9A P51151 1/20 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
SCHEMBL12530002 0.91 ENPP2 (0.46) ENPP2CHKAMGLLLPLLIPG
SCHEMBL19696374 0.87 CHKA (0.46) ENPP2CHKAMGLLBCHEACHE
SCHEMBL12530089 0.86 ENPP2 (0.42) ENPP2CHKAMGLLLPLLIPG
SCHEMBL12249821 0.85 ENPP2 (0.41) ENPP2CHKAMGLLLPLLIPG
SCHEMBL2737184 0.81 KDM4E (0.42) ENPP2CHKAMGLLBCHEACHE
SCHEMBL24044011 0.74 CA1 (0.44) CHKAMGLLBCHEACHEKDM4E
SCHEMBL12530382 0.74 KDM4E (0.40) CHKAMGLLBCHEACHEKDM4E
SCHEMBL10137237 0.73 CHKA (0.36) ENPP2CHKAKDM4EALDH1A1RAB9A
SCHEMBL5872608 0.73 ENPP2 (0.72) ENPP2MGLLLPLLIPGKDM4E
SCHEMBL19661291 0.73 BCHE (0.56) CHKABCHEACHEKDM4EALDH1A1

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
US-8838195-B2 Optical systems and methods for ratiometric measurement of blood glucose concentration MEDTRONIC MINIMED, INC. (US) 2014-09-16 US disclosed
US-8738107-B2 Equilibrium non-consuming fluorescence sensor for real time intravascular glucose measurement MEDTRONIC MINIMED, INC. (US) 2014-05-27 US disclosed
US-8498682-B2 Optical determination of pH and glucose GLUMETRICS, INC. (US) 2013-07-30 US disclosed
US-20100274110-A1 OPTICAL DETERMINATION OF PH AND GLUCOSE GluMetrics, Inc (US) 2010-10-28 US disclosed
US-7751863-B2 Optical determination of ph and glucose GLUMETRICS, INC. (US) 2010-07-06 US disclosed
US-20090018418-A1 EQUILIBRIUM NON-CONSUMING FLUORESCENCE SENSOR FOR REAL TIME INTRAVASCULAR GLUCOSE MEASUREMENT GLUMETRICS, INC. (US) 2009-01-15 US disclosed
US-20080188722-A1 OPTICAL DETERMINATION OF PH AND GLUCOSE MEDTRONIC MINIMED, INC. 2008-08-07 US disclosed
US-20080188725-A1 OPTICAL SYSTEMS AND METHODS FOR RATIOMETRIC MEASUREMENT OF BLOOD GLUCOSE CONCENTRATION MEDTRONIC MINIMED, INC. 2008-08-07 US disclosed