SCHEMBL278643

SCHEMBL278643

CCCCCn1cc(-c2nc(N)c3ncn(C4O[C@@H](CO)[C@H](O)[C@@H]4O)c3n2)cn1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 13/20 1.00
ADORA2B P29275 3/20 0.63

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
SCHEMBL272524 1.00 ADORA2A (1.00) ADORA2AADORA2B
SCHEMBL12003052 1.00 ADORA2A (1.00) ADORA2AADORA2B
SCHEMBL4329020 1.00 ADORA2A (1.00) ADORA2AADORA2B
SCHEMBL13437816 1.00 ADORA2A (1.00) ADORA2AADORA2B
SCHEMBL7804687 1.00 ADORA2A (1.00) ADORA2AADORA2B
SCHEMBL13403865 1.00 ADORA2A (1.00) ADORA2AADORA2B
SCHEMBL4065444 1.00 ADORA2A (1.00) ADORA2AADORA2B
SCHEMBL12003035 0.99 ADORA2A (0.98) ADORA2AADORA2B
SCHEMBL13403872 0.99 ADORA2A (0.98) ADORA2AADORA2B
SCHEMBL272221 0.99 ADORA2A (0.98) ADORA2AADORA2B

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 36 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8906878-B2 Myocardial perfusion imaging methods and compositions GILEAD SCIENCES, INC. (US) 2014-12-09 US disclosed
US-8906878-B2 Myocardial perfusion imaging methods and compositions GILEAD SCIENCES, INC. (US) 2014-12-09 US disclosed
US-20120251440-A1 METHODS OF MYOCARDIAL PERFUSION IMAGING GILEAD SCIENCES, INC. (US) 2012-10-04 US disclosed
US-20120251440-A1 METHODS OF MYOCARDIAL PERFUSION IMAGING GILEAD SCIENCES, INC. (US) 2012-10-04 US disclosed
US-20120195827-A1 MYOCARDIAL PERFUSION IMAGING METHODS AND COMPOSITIONS GILEAD SCIENCE, INC. 2012-08-02 US disclosed
US-20120195827-A1 MYOCARDIAL PERFUSION IMAGING METHODS AND COMPOSITIONS GILEAD SCIENCE, INC. 2012-08-02 US disclosed
US-8183226-B2 Myocardial perfusion imaging method GILEAD SCIENCES, INC. (US) 2012-05-22 US disclosed
US-8183226-B2 Myocardial perfusion imaging method GILEAD SCIENCES, INC. (US) 2012-05-22 US disclosed
US-8133879-B2 Myocardial perfusion imaging methods and compositions GILEAD SCIENCES, INC. (US) 2012-03-13 US disclosed
US-8133879-B2 Myocardial perfusion imaging methods and compositions GILEAD SCIENCES, INC. (US) 2012-03-13 US disclosed
US-20090081120-A1 Methods and Compositions for Increasing Patient Tolerability During Myocardial Imaging Methods CV THERAPEUTICS, INC. 2009-03-26 US disclosed
US-20080267861-A1 Myocardial Perfusion Imaging CV THERAPEUTICS, INC. (US) 2008-10-30 US disclosed
US-20080267861-A1 Myocardial Perfusion Imaging CV THERAPEUTICS, INC. (US) 2008-10-30 US disclosed
US-20080213165-A1 Methods and Compositions for Increasing Patent Tolerability During Myocardial Imaging Methods CV THERAPEUTICS, INC. 2008-09-04 US disclosed
US-20080213165-A1 Methods and Compositions for Increasing Patent Tolerability During Myocardial Imaging Methods CV THERAPEUTICS, INC. 2008-09-04 US disclosed
US-20080170990-A1 Methods for Myocardial Imaging in Patients Having a History of Pulmonary Disease CV THERAPEUTICS, INC. (US) 2008-07-17 US disclosed
US-20080170990-A1 Methods for Myocardial Imaging in Patients Having a History of Pulmonary Disease CV THERAPEUTICS, INC. (US) 2008-07-17 US disclosed
WO-2008028140-A1 METHODS AND COMPOSITIONS FOR INCREASING PATIENT TOLERABILITY DURING MYOCARDIAL IMAGING METHODS CV THERAPEUTICS, INC. (US) 2008-03-06 WO disclosed
US-20070299089-A1 Use of A2A Adenosine Receptor Agonists in the Treatment of Ischemia CV THERAPEUTICS, INC. 2007-12-27 US disclosed
US-20070299089-A1 Use of A2A Adenosine Receptor Agonists in the Treatment of Ischemia CV THERAPEUTICS, INC. 2007-12-27 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 (7 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-20070299089-A1 Use of A2A Adenosine Receptor Agonists in the Treatment of Ischemia ADORA2A, ADORA3, ADORA2B ADORA2A 1/4885ADORA2B 3/4885
US-20080267861-A1 Myocardial Perfusion Imaging TNNI3, FLT4, FABP3 ADORA2A 100/4885ADORA2B 92/4885
US-20120251440-A1 METHODS OF MYOCARDIAL PERFUSION IMAGING ADORA2A, ADORA3, ADORA2B ADORA2A 1/4885ADORA2B 3/4885
US-20080213165-A1 Methods and Compositions for Increasing Patent Tolerability During Myocardial Imaging Methods ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885ADORA2B 4/4885
US-20080170990-A1 Methods for Myocardial Imaging in Patients Having a History of Pulmonary Disease ADORA2A, ADORA3, ADRB3 ADORA2A 1/4885ADORA2B 5/4885
US-20090081120-A1 Methods and Compositions for Increasing Patient Tolerability During Myocardial Imaging Methods ADORA2A, FABP3, ADORA3 ADORA2A 1/4885ADORA2B 9/4885
US-20120195827-A1 MYOCARDIAL PERFUSION IMAGING METHODS AND COMPOSITIONS ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885ADORA2B 4/4885

“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.