SCHEMBL5046734

SCHEMBL5046734

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

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.45
KMT2A Q03164 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
MEN1 O00255 2/20 0.45
ALDH2 P05091 1/20 0.45
LMNA P02545 2/20 0.45
ALDH1A1 P00352 1/20 0.45
HTT P42858 1/20 0.45
HSD17B10 Q99714 1/20 0.45
KDM4E B2RXH2 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
RECQL P46063 1/20 0.43
LTA4H P09960 1/20 0.43
HPGD P15428 1/20 0.43
TP53 P04637 1/20 0.42

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
SCHEMBL810052 0.90 HDAC1 (0.45) ALDH2HTTLTA4HHPGD
SCHEMBL5046746 0.86 RECQL (0.48) MAPTL3MBTL1LMNAALDH1A1RECQL
SCHEMBL809993 0.84 PTGS2 (0.50) MAPTKMT2AL3MBTL1MEN1ALDH2
SCHEMBL4250581 0.82 KMT2A (0.58) MAPTKMT2AL3MBTL1MEN1ALDH2
SCHEMBL5049562 0.80 SMN1; SMN2 (0.46) MAPTKMT2AL3MBTL1LMNAALDH1A1
SCHEMBL11233455 0.79 MAPT (0.66) MAPTKMT2AMEN1LMNAALDH1A1
SCHEMBL4268398 0.78 CYP4F2 (0.51) MAPTKMT2AL3MBTL1MEN1ALDH2
SCHEMBL27637481 0.78 LMNA (0.50) MAPTL3MBTL1LMNAALDH1A1HPGD
SCHEMBL10738896 0.77 L3MBTL1 (0.68) MAPTKMT2AL3MBTL1LMNAALDH1A1
SCHEMBL7697086 0.77 MAPT (0.53) MAPTKMT2AL3MBTL1MEN1LMNA

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