Apaxifylline

Apaxifylline

SCHEMBL194806

CCCn1c(=O)c2[nH]c([C@H]3CCC(=O)C3)nc2n(CCC)c1=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ADORA1 P30542 10/20 1.00
▸ ADORA2A P29274 5/20 1.00
▸ ADORA2B P29275 4/20 1.00
▸ ADORA3 P0DMS8 2/20 0.73
▸ MEN1 O00255 1/20 0.73
▸ GMNN O75496 1/20 0.73
▸ LMNA P02545 1/20 0.73
▸ CYP1A2 P05177 1/20 0.73
▸ TSHR P16473 1/20 0.73
▸ PMP22 Q01453 1/20 0.73
▸ KMT2A Q03164 1/20 0.73
▸ HIF1A Q16665 1/20 0.73

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
Apaxifylline SCHEMBL194999 1.00 ADORA1 (1.00) ADORA1ADORA2AADORA2BADORA3MEN1
SCHEMBL4621677 0.87 ADORA1 (1.00) ADORA1ADORA2AADORA2BADORA3MEN1
1,3-Dipropyl-8-Cyclopentylxanthine [Dpcpx] SCHEMBL382422 0.85 ADORA1 (1.00) ADORA1ADORA2AADORA2BADORA3MEN1
SCHEMBL4623484 0.84 ADORA1 (1.00) ADORA1ADORA2AADORA2BADORA3MEN1
SCHEMBL8835935 0.83 ADORA1 (0.73) ADORA1ADORA2AADORA2BADORA3MEN1
SCHEMBL8836119 0.83 ADORA1 (0.73) ADORA1ADORA2AADORA2BADORA3MEN1
SCHEMBL8902076 0.82 ADORA1 (0.70) ADORA1ADORA2AADORA2BADORA3MEN1
SCHEMBL8902082 0.82 ADORA1 (0.70) ADORA1ADORA2AADORA2BADORA3MEN1
SCHEMBL9729354 0.82 ADORA1 (0.90) ADORA1ADORA2AADORA2BADORA3MEN1
SCHEMBL9729018 0.82 ADORA1 (0.90) ADORA1ADORA2AADORA2BADORA3MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9555037-B2 Method of using vasoconstrictive agents during energy-based tissue therapy COVIDIEN AG 2017-01-31 — — US claimed
US-20160151374-A1 METHOD OF USING VASOCONSTRICTIVE AGENTS DURING ENERGY-BASED TISSUE THERAPY SHERWOOD SERVICES AG (CH) 2016-06-02 — — US claimed
US-8268352-B2 Modified release composition for highly soluble drugs TORRENT PHARMACEUTICALS LIMITED (IN) 2012-09-18 — — US claimed
US-8263125-B2 Dosage form for high dose-high solubility active ingredients that provides for immediate release and modified release of the active ingredients TORRENT PHARMACEUTICALS LIMITED (IN) 2012-09-11 — — US claimed
US-8202242-B2 Method of using vasoconstrictive agents during energy-based tissue therapy COVIDIEN AG (CH) 2012-06-19 — — US claimed
US-7767686-B2 Method of using adenosine receptor blockers during tissue ablation COVIDIEN AG (CH) 2010-08-03 — — US claimed
CN-101330905-A Freeze-drying process and products obtained thereby SCIDOSE LLC (US) 2008-12-24 — — CN claimed
US-20080275068-A1 administering a vasoconstrictive agent such as an adenosine receptor antagonist ( 1,3-dipropyl-8-cyclopentylxanthine, 8-(3-Chlorostyryl)caffeine, 6-carboxy-methyl-5,9-dihydro-9-methyl-2-phenyl-[1,2,4]-triazolo[5,1-a][2,7]naphthyridine) to the mammal to increases the size of the coagulation zone COVIDIEN AG (CH) 2008-11-06 — — US claimed
US-20080045551-A1 PHARMACEUTICAL COMBINATION COMPRISING AN ADENOSINE A1 ANTAGONIST AND A RADIOCONTRAST MEDIA SOLVAY PHARMACEUTICALS GMBH (DE) 2008-02-21 — — US claimed
EP-1870093-A1 Pharmaceutical combination comprising adenosine A1 receptor antagonists and radiocontrast media Solvay Pharmaceuticals GmbH (DE) 2007-12-26 — — EP claimed
US-20060024365-A1 Novel dosage form VAYA NAVIN 2006-02-02 — — US claimed
US-20060018933-A1 Novel drug delivery system TORRENT PHARMACEUTICALS LIMITED (IN) 2006-01-26 — — US claimed
US-20060018934-A1 Novel drug delivery system TORRENT PHARMACEUTICALS LIMITED (IN) 2006-01-26 — — US claimed
CN-1564688-A Methods of treating pulmonary disease BIOGEN IDEC INC (US) 2005-01-12 — — CN claimed
US-20040259889-A1 Methods of treating pulmonary disease BIOGEN IDEC MA INC. 2004-12-23 — — US claimed
EP-1429775-A1 METHODS OF TREATING PULMONARY DISEASE Biogen Idec MA Inc. (US) 2004-06-23 — — EP claimed
EP-1336602-A1 Nitrate prodrugs able to release nitric oxide in a controlled and selective way and their use for prevention and treatment of inflammatory, ischemic and proliferative diseases Scaramuzzino, Giovanni (IT) 2003-08-20 — — EP claimed
WO-2003022284-A1 METHODS OF TREATING PULMONARY DISEASE BIOGEN IDEC MA INC. (US) 2003-03-20 — — WO claimed
US-5696124-A Xanthine derivatives with adenosine-antagonistic activity BOEHRINGER INGELHEIM KG (DE) 1997-12-09 — — US claimed
EP-0374808-B1 Xanthin derivatives having an adenosin-antagonist activity BOEHRINGER INGELHEIM KG (DE) 1996-04-17 — — 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-20040259889-A1 Methods of treating pulmonary disease ADORA1, ADORA2A, TBXA2R ADORA1 1/4885ADORA2A 2/4885ADORA2B 5/4885
US-20160151374-A1 METHOD OF USING VASOCONSTRICTIVE AGENTS DURING ENERGY-BASED TISSUE THERAPY PLAT, TEK, PLG ADORA1 503/4885ADORA2A 271/4885ADORA2B 339/4885
US-20080275068-A1 administering a vasoconstrictive agent such as an adenosine receptor antagonist ( 1,3-dipropyl-8-cyclopentylxanthine, 8-(3-Chlorostyryl)caffeine, 6-carboxy-methyl-5,9-dihydro-9-methyl-2-phenyl-[1,2,4]-triazolo[5,1-a][2,7]naphthyridine) to the mammal to increases the size of the coagulation zone ADORA2A, ADORA1, ADORA3 ADORA1 2/4885ADORA2A 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.

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