SCHEMBL6661645

SCHEMBL6661645

CC(O)C(O)[CH]CC=O

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL27755418 0.71
SCHEMBL6435367 0.69
SCHEMBL5692857 0.69
SCHEMBL8652032 0.67
SCHEMBL13573722 0.67
SCHEMBL6440069 0.67
SCHEMBL9793720 0.67
SCHEMBL9793691 0.67
SCHEMBL27583013 0.65
SCHEMBL1784889 0.65

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1256380-B1 Adsorbents for blood perfusion and their preparation method THIES KARSTEN DR (DE) 2004-08-25 EP disclosed
WO-2002089975-A1 ADSORBENTS FOR THE PERFUSION OF BLOOD AND CORRESPONDING PRODUCTION METHOD THIES KARSTEN (DE) 2002-11-14 WO disclosed
EP-1256380-A1 Adsorbents for blood perfusion and their preparation method Thies, Karsten, Dr. (DE) 2002-11-13 EP disclosed
US-5401415-A Hydroxy and ether containing ligands attached to glass beads via silanol groups, low density lipoproteins B. BRAUN MELSUNGEN AG (DE) 1995-03-28 US disclosed
EP-0533727-B1 ADSORBENT MATERIAL FOR SELECTIVE REMOVAL OF LDL OR/AND vLDL BRAUN MELSUNGEN AG (DE) 1994-01-19 EP disclosed