SCHEMBL859643

SCHEMBL859643

CC(Cc1ccccc1)OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA1 P30542 5/20 0.67
AHCY P23526 2/20 0.61
NADK O95544 1/20 0.61
ADORA3 P0DMS8 3/20 0.60
ADORA2A P29274 3/20 0.60
SMN1; SMN2 Q16637 2/20 0.60
DOT1L Q8TEK3 2/20 0.60
ADORA2B P29275 2/20 0.60
DPP4 P27487 1/20 0.60
MEN1 O00255 1/20 0.60
SLC28A1 O00337 1/20 0.60
MAP3K7 O43318 1/20 0.60
SLC28A2 O43868 1/20 0.60
GAPDH P04406 1/20 0.60
MAPK1 P28482 1/20 0.60
STAT6 P42226 1/20 0.60
PI4KA P42356 1/20 0.60
KMT2A Q03164 1/20 0.60
PI4K2B Q8TCG2 1/20 0.60
SLC29A1 Q99808 1/20 0.60

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
SCHEMBL1553926 1.00 ADORA1 (0.67) ADORA1AHCYNADKADORA3ADORA2A
SCHEMBL13268819 0.88 ADORA1 (0.68) ADORA1AHCYNADKADORA3ADORA2A
SCHEMBL13268689 0.88 ADORA1 (0.68) ADORA1AHCYNADKADORA3ADORA2A
SCHEMBL13269093 0.88 ADORA1 (0.68) ADORA1AHCYNADKADORA3ADORA2A
SCHEMBL7027633 0.88 ADORA1 (0.69) ADORA1AHCYNADKADORA3ADORA2A
SCHEMBL7435435 0.86 AHCY (0.71) ADORA1AHCYNADKADORA3ADORA2A
SCHEMBL10710453 0.86 ADORA1 (0.68) ADORA1AHCYNADKADORA3ADORA2A
SCHEMBL7872477 0.85 ADORA1 (0.67) ADORA1AHCYNADKADORA3ADORA2A
SCHEMBL13268621 0.85 AHCY (0.58) ADORA1AHCYNADKADORA3ADORA2A
Adenosine Phosphate SCHEMBL1050410 0.85 P2RY1 (0.76) ADORA1SMN1; SMN2DNPH1PRKAB2TRPM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5070877-A Using adenosin receptor agonist MEDCO RESEARCH, INC. (US) 1991-12-10 US claimed
EP-0181129-B1 N6-SUBSTITUTED DEOXYRIBOSE ANALOGS OF ADENOSINES WARNER-LAMBERT COMPANY (US) 1989-03-08 EP claimed
EP-0181129-A2 N6-substituted deoxyribose analogs of adenosines WARNER-LAMBERT COMPANY (US) 1986-05-14 EP claimed
JP-4124143-A None JP disclosed
EP-1718757-B1 GLIMEPIRIDE- AND INSULIN-INDUCED GLYCOSYLPHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C REGULATION SANOFI AVENTIS DEUTSCHLAND (DE) 2012-03-28 EP disclosed
US-8017350-B2 Glimepiride- and insulin-induced glycosylphosphatidylinositol-specific phospholipase C regulation SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2011-09-13 US disclosed
US-7449560-B2 Phosophoinositoglycan binding proteins SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-11-11 US disclosed
US-20070111263-A1 GLIMEPIRIDE- AND INSULIN-INDUCED GLYCOSYLPHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C REGULATION SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2007-05-17 US disclosed
EP-1718757-A2 GLIMEPIRIDE- AND INSULIN-INDUCED GLYCOSYLPHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C REGULATION Sanofi-Aventis Deutschland GmbH (DE) 2006-11-08 EP disclosed
US-20060160142-A1 Phosophoinositoglycan binding proteins SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-07-20 US disclosed
US-7049416-B2 Phosophoinositoglycan binding proteins SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2006-05-23 US disclosed
WO-1998039008-A1 METHODS AND COMPOSITIONS FOR PROTECTING AGAINST CARDIAC ISCHEMIA BY ADMINISTERING ADENOSINE A2A RECEPTOR ANTAGONISTS TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) 1998-09-11 WO disclosed
JP-H04124143-A CARDIAC INFARCTION MEDICINE CONTAINING ADENOSINE OR ITS RELATED COMPOUND AS ACTIVE INGREDIENT MEDCO RES INC 1992-04-24 JP disclosed
US-5070877-A Using adenosin receptor agonist MEDCO RESEARCH, INC. (US) 1991-12-10 US disclosed
US-5070877-A Using adenosin receptor agonist MEDCO RESEARCH, INC. (US) 1991-12-10 US disclosed
EP-0354638-A3 USE OF ADENOSINE AND ITS DERIVATIVES IN DIAGNOSIS MEDCO RESEARCH INC (US) 1990-09-26 EP disclosed
EP-0354638-A2 Use of adenosine and its derivatives in diagnosis MEDCO RESEARCH INC (US) 1990-02-14 EP disclosed
EP-0354638-A2 Use of adenosine and its derivatives in diagnosis MEDCO RESEARCH INC (US) 1990-02-14 EP disclosed
EP-0181129-B1 N6-SUBSTITUTED DEOXYRIBOSE ANALOGS OF ADENOSINES WARNER-LAMBERT COMPANY (US) 1989-03-08 EP disclosed
EP-0181129-A2 N6-substituted deoxyribose analogs of adenosines WARNER-LAMBERT COMPANY (US) 1986-05-14 EP 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 (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-20070111263-A1 GLIMEPIRIDE- AND INSULIN-INDUCED GLYCOSYLPHOSPHATIDYLINOSITOL-SPECIFIC PHOSPHOLIPASE C REGULATION GPR119, GID4, PLD1 ADORA1 1621/4885AHCY 1348/4885NADK 1833/4885

“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.