SCHEMBL5046746

SCHEMBL5046746

COC(=O)COC(=O)CCOc1ccc(OC(C)C(=O)OCC(=O)OC)cc1

nearest known ligand 0.51

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.48
MAPT P10636 2/20 0.47
TP53 P04637 1/20 0.47
ALDH1A1 P00352 3/20 0.46
LMNA P02545 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
GAA P10253 1/20 0.45
POLB P06746 2/20 0.44

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
SCHEMBL4262686 0.87 KMT2A (0.48) MAPTALDH1A1LMNAL3MBTL1GAA
SCHEMBL5046734 0.86 MAPT (0.45) RECQLMAPTTP53ALDH1A1LMNA
SCHEMBL809993 0.80 PTGS2 (0.50) MAPTALDH1A1LMNAL3MBTL1GAA
SCHEMBL810052 0.77 HDAC1 (0.45) GAA
SCHEMBL16261865 0.76 L3MBTL1 (0.43) RECQLMAPTALDH1A1LMNAL3MBTL1
SCHEMBL27637481 0.73 LMNA (0.50) MAPTALDH1A1LMNAL3MBTL1GAA
SCHEMBL16262351 0.73 L3MBTL1 (0.41) RECQLMAPTTP53ALDH1A1LMNA
SCHEMBL16261810 0.73 MAPT (0.47) MAPTALDH1A1LMNAL3MBTL1GAA
SCHEMBL13935133 0.72 PTGS2 (0.58) MAPTALDH1A1LMNAL3MBTL1GAA
SCHEMBL4264046 0.72 PTGS2 (0.58) MAPTALDH1A1LMNAL3MBTL1GAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1951260-A2 FUNCTIONALIZED PHENOLIC COMPOUNDS AND ABSORBABLE THEREFROM Bezwada Biomedical LLC (US) 2008-08-06 EP disclosed
WO-2007053794-A2 FUNCTIONALIZED PHENOLIC COMPOUNDS AND ABSORBABLE THEREFROM BEZWADA BIOMEDICAL LLC (US) 2007-05-10 WO disclosed