SCHEMBL789235

SCHEMBL789235

CCCCCCC#Cc1nc(N)c2ncn([C@@H]3O[C@H](CO)C(O)C3O)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 8/20 1.00
ADORA2B P29275 4/20 1.00
ADORA3 P0DMS8 4/20 0.93
ADORA1 P30542 1/20 0.93

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
SCHEMBL15257780 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL789234 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL12958834 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL9173411 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL6938649 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL9173436 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL5737339 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL9166176 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL21710733 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1
SCHEMBL7070428 1.00 ADORA2A (1.00) ADORA2AADORA2BADORA3ADORA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240358663-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PULMONARY ARTERIAL HYPERTENSION THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2024-10-31 US claimed
US-20190160029-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PULMONARY ARTERIAL HYPERTENSION NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-05-30 US claimed
WO-2017192553-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PULMONARY ARTERIAL HYPERTENSION THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2017-11-09 WO claimed
US-20160338947-A1 DEVICE THAT DELIVERS A SUSTAINED LOW-DOSE OF A MYOPIA-SUPPRESSING DRUG, WHILE PRESERVING PUPILLARY FUNCTION AND ACCOMMODATION AMORPHEX THERAPEUTICS LLC 2016-11-24 US claimed
WO-2016187426-A1 A DEVICE THAT DELIVERS A SUSTAINED LOW-DOSE OF A MYOPIA-SUPPRESSING DRUG AMORPHEX THERAPEUTICS LLC (US) 2016-11-24 WO claimed
US-20130224110-A1 USE OF ADENOSINE RECEPTOR SIGNALING TO MODULATE PERMEABILITY OF BLOOD-BRAIN BARRIER CORNELL UNIVERSITY (US) 2013-08-29 US claimed
EP-2616538-A1 USE OF ADENOSINE RECEPTOR SIGNALING TO MODULATE PERMEABILITY OF BLOOD-BRAIN BARRIER Cornell University (US) 2013-07-24 EP claimed
WO-2012037457-A1 USE OF ADENOSINE RECEPTOR SIGNALING TO MODULATE PERMEABILITY OF BLOOD-BRAIN BARRIER CORNELL UNIVERSITY (US) 2012-03-22 WO claimed
US-20110262442-A1 COMPOSITIONS FOR TREATING CNS DISORDERS ADENIOS, INC. (US) 2011-10-27 US claimed
US-20110189255-A1 DRUG-ELUTING STENTS FOR ADENOSINE RECEPTOR MODULATION PURDUE RESEARCH FOUNDATION 2011-08-04 US claimed
US-6387889-B1 REDUCING OCULAR TENSION YAMASA CORPORATION (JP) 2002-05-14 US claimed
US-6372723-B1 Compositions and methods for preventing restenosis following revascularization procedures DISCOVERY THERAPEUTICS, INC. 2002-04-16 US claimed
JP-2002505687-A 2002-02-19 JP claimed
US-6339072-B2 Compositions and methods for preventing restenosis following revascularization procedures DISCOVERY THERAPEUTICS INC. 2002-01-15 US claimed
US-20010009907-A1 Compositions and methods for preventing restenosis following revascularization procedures DISCOVERY THERAPEUTICS, INC. 2001-07-26 US claimed
EP-1110554-A1 MEDICINAL COMPOSITIONS FOR TREATING EYE DISEASES YAMASA CORPORATION (JP) 2001-06-27 EP claimed
EP-1014995-A1 COMPOSITIONS AND METHODS FOR PREVENTING RESTENOSIS FOLLOWING REVASCULARIZATION PROCEDURES Discovery Therapeutics, Inc. (US) 2000-07-05 EP claimed
EP-0983768-A1 MEDICINAL COMPOSITION FOR PREVENTION OR TREATMENT OF HEPATOPATHY Nippon Shinyaku Co., Ltd. (JP) 2000-03-08 EP claimed
WO-1998057651-A1 COMPOSITIONS AND METHODS FOR PREVENTING RESTENOSIS FOLLOWING REVASCULARIZATION PROCEDURES DISCOVERY THERAPEUTICS, INC. (US) 1998-12-23 WO claimed
EP-0499185-B1 Stable solid 2-octynyl adenosine and process for producing the same YAMASA SHOYU KK (JP) 1995-05-17 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 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-20160338947-A1 DEVICE THAT DELIVERS A SUSTAINED LOW-DOSE OF A MYOPIA-SUPPRESSING DRUG, WHILE PRESERVING PUPILLARY FUNCTION AND ACCOMMODATION MYOC, STRA6, MYOF ADORA2A 735/4885ADORA2B 1684/4885ADORA3 1747/4885
US-20240358663-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PULMONARY ARTERIAL HYPERTENSION VASP, MYLK, EDNRB ADORA2A 7/4885ADORA2B 37/4885ADORA3 59/4885
US-20190160029-A1 COMPOSITIONS AND METHODS FOR THE TREATMENT OF PULMONARY ARTERIAL HYPERTENSION VASP, MYLK, EDNRB ADORA2A 7/4885ADORA2B 37/4885ADORA3 59/4885

“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.