SCHEMBL8729152

SCHEMBL8729152

CN(CC(=O)OC(=O)CCC(=O)c1ccccc1)C(=O)c1ccccc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.49
L3MBTL1 Q9Y468 5/20 0.47
MAPT P10636 3/20 0.47
MEN1 O00255 2/20 0.47
HPGD P15428 2/20 0.47
NR4A2 P43354 1/20 0.46
ALDH1A1 P00352 3/20 0.43
USP2 O75604 2/20 0.43
KDM4E B2RXH2 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC6 Q9UBN7 1/20 0.43
GAA P10253 1/20 0.42
CYP2C19 P33261 1/20 0.42
LMNA P02545 3/20 0.42
TDP1 Q9NUW8 1/20 0.42
PRSS1 P07477 1/20 0.42
CTSG P08311 1/20 0.42
CTRB1 P17538 1/20 0.42
CMA1 P23946 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.41

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
SCHEMBL6205636 0.82 NR4A2 (0.65) KMT2AL3MBTL1MAPTMEN1HPGD
SCHEMBL8729148 0.80 NR4A2 (0.65) KMT2AL3MBTL1MAPTMEN1HPGD
SCHEMBL6205642 0.79 NR4A2 (0.57) KMT2AL3MBTL1MAPTMEN1HPGD
SCHEMBL11606625 0.79 ALDH1A1 (0.55) KMT2AL3MBTL1MAPTMEN1HPGD
SCHEMBL4826769 0.78 NR4A2 (0.55) KMT2AL3MBTL1MAPTMEN1HPGD
SCHEMBL4495709 0.77 KMT2A (0.69) KMT2AL3MBTL1MEN1HPGDALDH1A1
SCHEMBL2282162 0.73 KMT2A (0.53) KMT2AMEN1HPGDALDH1A1HDAC1
SCHEMBL13545171 0.73 KMT2A (0.49) KMT2AMAPTMEN1HPGDALDH1A1
SCHEMBL135356 0.72 NR4A2 (0.61) KMT2AL3MBTL1MAPTMEN1HPGD
SCHEMBL13337842 0.72 KMT2A (0.51) KMT2AMEN1HPGDALDH1A1HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0865439-A4 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS INC (US) 1998-11-11 EP disclosed
EP-0865439-A1 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS, INC. (US) 1998-09-23 EP disclosed
WO-1996040672-A1 COMBINATORIAL LIBRARIES HAVING AMINODIOL MONOMER SUBUNITS ISIS PHARMACEUTICALS, INC. (US) 1996-12-19 WO disclosed