SCHEMBL6636036

SCHEMBL6636036

CCN(C=O)C(O)[C@H]1O[C@@H](n2cnc3c(NCl)ncnc32)[C@H](O)[C@@H]1O

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ADORA2A P29274 3/20 0.52
ADORA2B P29275 3/20 0.52
PRMT5 O14744 4/20 0.51
WDR77 Q9BQA1 4/20 0.51
ADORA3 P0DMS8 2/20 0.48
ADORA1 P30542 1/20 0.48

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
SCHEMBL5685741 0.87 ADORA2A (0.61) ADORA2AADORA2BADORA3ADORA1
SCHEMBL7744261 0.87 AHCY (0.46) ADORA2AADORA2BPRMT5WDR77
SCHEMBL7161647 0.86 ADORA2A (0.63) ADORA2AADORA2BADORA3ADORA1
SCHEMBL29877256 0.86 AHCY (0.61) ADORA2AADORA2BADORA3ADORA1
SCHEMBL177772 0.86 AHCY (0.61) ADORA2AADORA2BADORA3ADORA1
SCHEMBL28901883 0.86 AHCY (0.61) ADORA2AADORA2BADORA3ADORA1
SCHEMBL1320875 0.85 ADORA3 (0.64) ADORA3
SCHEMBL258935 0.78 ADORA3 (0.59) ADORA2AADORA2BADORA3ADORA1
SCHEMBL4327814 0.76 ADORA2A (0.53) ADORA2AADORA2BPRMT5WDR77ADORA3
SCHEMBL7744279 0.75 AHCY (0.47) ADORA2AADORA2BPRMT5WDR77ADORA3

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0758897-B1 COMPOUNDS HAVING ANTIHYPERTENSIVE, CARDIOPROTECTIVE, ANTI-ISCHEMIC AND ANTILIPOLYTIC PROPERTIES AVENTIS PHARM PROD INC (US) 2004-02-25 EP disclosed
US-6392049-B1 NITRATION USING NITRIC ACID AVENTIS PHARMACEUTICALS INC. 2002-05-21 US disclosed
US-6307054-B1 HEATING A 5-CARBOXY-2,4-DIHYROXYPYRIDINE AND PHOSPHORIC ACID WHERE THE RATIO OF PHOSPHORIC ACID TO WATER IS NOT LESS THAN ABOUT 27 TO 1 WEIGHT %. AVENTIS PHARMACEUTICALS PRODUCTS INC. 2001-10-23 US disclosed
EP-1006115-A2 Imidazopyridines having antihypertensive, cardioprotective, anti-ischemic and antilipolytic properties RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 2000-06-07 EP disclosed
US-5736554-A TREATING AND/OR PREVENTING CARDIOVASCULAR DISORDERS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1998-04-07 US disclosed
EP-0758897-A4 COMPOUNDS HAVING ANTIHYPERTENSIVE, CARDIOPROTECTIVE, ANTI-ISCHEMIC AND ANTILIPOLYTIC PROPERTIES RHONE POULENC RORER PHARMA (US) 1997-11-19 EP disclosed
US-5652366-A ADENOSINE AGONISTS; HYPOTENSIVE, CARDIOPROTECTIVE, ANTI-ISCHEMIC, AND ANTILIPOLYTIC AGENTS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-29 US disclosed
EP-0758897-A1 COMPOUNDS HAVING ANTIHYPERTENSIVE, CARDIOPROTECTIVE, ANTI-ISCHEMIC AND ANTILIPOLYTIC PROPERTIES RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1997-02-26 EP disclosed
US-5561134-A ADENOSINE DERIVATIVES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1996-10-01 US disclosed
WO-1995028160-A1 COMPOUNDS HAVING ANTIHYPERTENSIVE, CARDIOPROTECTIVE, ANTI-ISCHEMIC AND ANTILIPOLYTIC PROPERTIES RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1995-10-26 WO disclosed
US-5364862-A Adenosine derivatives RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1994-11-15 US disclosed