Cgs-21680

Cgs-21680

SCHEMBL724685

CCNC(=O)[C@H]1O[C@@H](n2cnc3c(N)nc(NCCc4ccc(CCC(=O)O)cc4)nc32)[C@@H](O)[C@@H]1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 9/20 1.00
ADORA3 P0DMS8 7/20 1.00
ADORA1 P30542 7/20 1.00
ADORA2B P29275 4/20 1.00
KDM4E B2RXH2 3/20 1.00
ALOX15 P16050 2/20 1.00
HSD17B10 Q99714 2/20 1.00
KMT2A Q03164 2/20 1.00
TSHR P16473 1/20 1.00
MEN1 O00255 1/20 1.00
ALDH1A1 P00352 1/20 1.00
CYP2D6 P10635 1/20 1.00
CYP2C19 P33261 1/20 1.00
PMP22 Q01453 1/20 0.98
ATM Q13315 1/20 0.98

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
Cgs-21680 SCHEMBL12648395 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL13285993 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL14397691 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL3730487 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL2318561 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL24178317 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL724684 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL19807521 1.00 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL26629876 0.99 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E
Cgs-21680 SCHEMBL29381841 0.99 ADORA2A (1.00) ADORA2AADORA3ADORA1ADORA2BKDM4E

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-20210106605-A1 Adenosine Receptor Modulators for the Treatment of Circadian Rhythm Disorders OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2021-04-15 US claimed
US-20190111069-A1 Adenosine Receptor Modulators for the Treatment of Circadian Rhythm Disorders OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2019-04-18 US claimed
US-20180344655-A1 FUNCTIONALIZED POLYMERIC PARTICLES FOR TREATMENT OF GLIOMAS YALE UNIVERSITY 2018-12-06 US claimed
EP-3280414-A1 ADENOSINE RECEPTOR MODULATORS FOR THE TREATMENT OF CIRCADIAN RHYTHM DISORDERS Oxford University Innovation Limited (GB) 2018-02-14 EP claimed
WO-2017178820-A1 ADENOSINE RECEPTOR MODULATORS FOR THE TREATMENT OF CIRCADIAN RHYTHM DISORDERS OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2017-10-19 WO claimed
WO-2016183217-A1 FUNCTIONALIZED POLYMERIC PARTICLES FOR TREATMENT OF GLIOMAS YALE UNIVERSITY (US) 2016-11-17 WO claimed
US-20250295604-A1 FUNCTIONALIZED POLYMERIC PARTICLES FOR TREATMENT OF GLIOMAS YALE UNIVERSITY 2025-09-25 US disclosed
US-11931374-B2 Adenosine receptor modulators for the treatment of circadian rhythm disorders OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2024-03-19 US disclosed
EP-3280414-B1 ADENOSINE RECEPTOR MODULATORS FOR THE TREATMENT OF CIRCADIAN RHYTHM DISORDERS UNIV OXFORD INNOVATION LTD (GB) 2023-08-23 EP disclosed
US-20210106605-A1 Adenosine Receptor Modulators for the Treatment of Circadian Rhythm Disorders OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2021-04-15 US disclosed
US-10953015-B2 Use of adenosine receptor signaling to regulate P-gp function CORNELL UNIVERSITY (US) 2021-03-23 US disclosed
EP-3039126-B1 SMALL MOLECULE CELLULAR REPROGRAMMING TO GENERATE NEURONAL CELLS THE J DAVID GLADSTONE INST A TESTAMENTARY TRUST ESTABLISHED UNDER THE WILL OF J DAVID GLADSTONE (US) 2019-10-09 EP disclosed
US-20190111069-A1 Adenosine Receptor Modulators for the Treatment of Circadian Rhythm Disorders OXFORD UNIVERSITY INNOVATION LIMITED (GB) 2019-04-18 US disclosed
WO-2012027695-A1 METHODS AND COMPOSITIONS FOR PREVENTING OR TREATING OBESITY NORTHEASTERN UNIVERSITY (US) 2012-03-01 WO disclosed
US-20110288478-A1 BALLOON CATHETER EXHIBITING RAPID INFLATION AND DEFLATION ABBOTT CARDIOVASCULAR SYSTEMS INC. 2011-11-24 US disclosed
WO-2011143442-A1 A METHOD OF TREATING MULTIPLE SCLEROSIS WITH ADENOSINE RECEPTOR AGONISTS TROVIS PHARMACEUTICALS, LLC. (US) 2011-11-17 WO disclosed
US-20110270225-A1 METHOD FOR INCREASED UPTAKE OF BENEFICIAL AGENT AND EJECTION FRACTION BY POSTCONDITIONING PROCEDURES ABBOTT CARDIOVASCULAR SYSTEMS INC. 2011-11-03 US disclosed
EP-2240020-A1 INTRATHECAL TREATMENT OF NEUROPATHIC PAIN WITH A2AR AGONISTS Pgx Health, Llc (US) 2010-10-20 EP disclosed
WO-2009089425-A1 INTRATHECAL TREATMENT OF NEUROPATHIC PAIN WITH A2AR AGONISTS PGXHEALTH LLC (US) 2009-07-16 WO disclosed
US-20090181920-A1 INTRATHECAL TREATMENT OF NEUROPATHIC PAIN WITH A2AR AGONISTS PGXHEALTH, LLC (US) 2009-07-16 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 (6 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-20250295604-A1 FUNCTIONALIZED POLYMERIC PARTICLES FOR TREATMENT OF GLIOMAS PHLPP1, PHLPP2, PLAA ADORA2A 10/4885ADORA3 32/4885ADORA1 39/4885
US-20210106605-A1 Adenosine Receptor Modulators for the Treatment of Circadian Rhythm Disorders ADORA2A, ADORA2B, ADORA3 ADORA2A 1/4885ADORA3 3/4885ADORA1 4/4885
US-11931374-B2 Adenosine receptor modulators for the treatment of circadian rhythm disorders ADORA2A, ADORA2B, ADORA3 ADORA2A 1/4885ADORA3 3/4885ADORA1 4/4885
US-20180344655-A1 FUNCTIONALIZED POLYMERIC PARTICLES FOR TREATMENT OF GLIOMAS PHLPP1, PHLPP2, PLAA ADORA2A 10/4885ADORA3 32/4885ADORA1 39/4885
US-20090181920-A1 INTRATHECAL TREATMENT OF NEUROPATHIC PAIN WITH A2AR AGONISTS ADORA2A, ADORA3, ADORA1 ADORA2A 1/4885ADORA3 2/4885ADORA1 3/4885
US-20190111069-A1 Adenosine Receptor Modulators for the Treatment of Circadian Rhythm Disorders ADORA2A, ADORA2B, ADORA3 ADORA2A 1/4885ADORA3 3/4885ADORA1 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.