Rolofylline

Rolofylline

SCHEMBL720438

CCCn1c(=O)c2[nH]c(C34CC5CC(CC3C5)C4)nc2n(CCC)c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ADORA1

The experimentally established mechanism targets of Rolofylline. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ADORA1 known ✓ P30542 11/20 1.00
ADORA2A P29274 8/20 1.00
ADORA2B P29275 5/20 1.00
ADORA3 P0DMS8 4/20 1.00
SLC6A3 Q01959 1/20 1.00
SLC22A6 Q4U2R8 1/20 1.00
SLC22A8 Q8TCC7 1/20 1.00
SLC22A11 Q9NSA0 1/20 1.00
MEN1 O00255 1/20 0.79
MAPT P10636 1/20 0.79
KMT2A Q03164 1/20 0.79

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
SCHEMBL14051422 0.95 ADORA1 (0.91) ADORA1ADORA2AADORA2BADORA3SLC6A3
Rolofylline SCHEMBL13414155 0.94 ADORA1 (0.88) ADORA1ADORA2AADORA2BADORA3SLC6A3
SCHEMBL7270718 0.93 ADORA1 (1.00) ADORA1ADORA2AADORA2BADORA3SLC6A3
SCHEMBL8707422 0.93 ADORA1 (0.86) ADORA1ADORA2AADORA2BADORA3SLC6A3
SCHEMBL8705557 0.93 ADORA1 (0.92) ADORA1ADORA2AADORA2BADORA3SLC6A3
Rolofylline SCHEMBL13414105 0.92 ADORA1 (0.86) ADORA1ADORA2AADORA2BADORA3SLC6A3
SCHEMBL8707145 0.92 ADORA1 (0.84) ADORA1ADORA2AADORA2BADORA3SLC6A3
SCHEMBL8709754 0.91 ADORA1 (0.83) ADORA1ADORA2AADORA2BADORA3SLC6A3
SCHEMBL8705276 0.91 ADORA1 (0.82) ADORA1ADORA2AADORA2BADORA3SLC6A3
SCHEMBL8704417 0.91 ADORA1 (0.82) ADORA1ADORA2AADORA2BADORA3SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4648778-A1 METHOD FOR TREATING NETOSIS-MEDIATED DISEASES National Health Research Institutes (TW) 2025-11-19 EP claimed
WO-2024151651-A1 METHOD FOR TREATING NETOSIS-MEDIATED DISEASES NATIONAL HEALTH RESEARCH INSTITUTES (TW) 2024-07-18 WO claimed
US-20210393857-A1 SMALL MOLECULE DRUGS AND METHODS TO ACCELERATE OSSEOINTEGRATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2021-12-23 US claimed
EP-3876871-A1 SMALL MOLECULE DRUGS AND METHODS TO ACCELERATE OSSEOINTEGRATION The Regents of the University of California (US) 2021-09-15 EP claimed
US-10024795-B2 Method for monitoring vesicles using a membrane-permeable marker that is converted into a membrane-nonpermeable marker SAMSUNG ELECTRONICS CO., LTD. (KR) 2018-07-17 US claimed
EP-2708897-B1 Compositions and methods for detecting and analyzing vesicles SAMSUNG ELECTRONICS CO LTD (KR) 2017-09-06 EP claimed
CN-101977594-B Suffer from the authentication method of patient and the treatment of this patient that mild cognitive impairment needs treatment B.R.A.H.M.S GMBH (DE) 2015-09-02 CN claimed
EP-2247287-B1 Method for the identification of patients in need of therapy having minor cognitive disorders and the treatment of such patients BRAHMS GMBH (DE) 2015-08-12 EP claimed
US-20140099652-A1 COMPOSITION FOR MONITORING VESICLE, KIT AND METHOD OF MONITORING VESICLE USING THE SAME SAMSUNG ELECTRONICS CO., LTD. (KR) 2014-04-10 US claimed
US-20140080136-A1 COMPOSITIONS, KITS, AND METHODS FOR DETECTING AND ANALYZING VESICLES SAMSUNG ELECTRONICS CO., LTD. (KR) 2014-03-20 US 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
US-6210687-B1 EXHIBITS AN ADENOSINE A1 RECEPTOR ANTAGONIZING ACTIVITY, AND WHICH HAS ANTIHYPERTENSIVE ACTIVITY, DIURETIC ACTIVITY, KIDNEY-PROTECTING ACTIVITY, BRONCHIODILATARY ACTIVITY, BRAIN FUNCTION-IMPROVING ACTIVITY AND ANTIDEMENTIAL ACTIVITY. KYOWA HAKKO KOGYO CO., LTD. (JP) 2001-04-03 US claimed
EP-0970696-A1 Combination of loop diuretics with adenosine A1-receptor antagonists KYOWA HAKKO KOGYO CO., LTD. (JP) 2000-01-12 EP claimed
EP-0958821-A1 FAT EMULSION CONTAINING XANTHINE DERIVATIVE KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-11-24 EP claimed
WO-1998030900-A2 SCREENING METHOD FOR COMPOUNDS ACTIVE IN TREATING MYOPIA AND HYPERMETROPIA KLAUS TRIER APS (DK) 1998-07-16 WO claimed
EP-0415456-B1 Xanthine compounds KYOWA HAKKO KOGYO KK (JP) 1996-06-26 EP claimed
US-5504090-A Compositions and methods for the prevention and treatment of ischemia-reperfusion organ injury TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1996-04-02 US claimed
US-5290782-A Bronchodilator agents, diuretics for renal protective agents KYOWA HAKKO KOGYO CO., LTD. (JP) 1994-03-01 US claimed
EP-0415456-A2 Xanthine compounds KYOWA HAKKO KOGYO CO., LTD. (JP) 1991-03-06 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 (1 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-20210393857-A1 SMALL MOLECULE DRUGS AND METHODS TO ACCELERATE OSSEOINTEGRATION PER2, NCOR2, NR4A2 ADORA1 577/4885ADORA2A 254/4885ADORA2B 672/4885

“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.