SCHEMBL2426682

SCHEMBL2426682

CCCCC(C(=O)O)C(O)(C(=O)O)C(CCCC)(CC(=O)OC)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.56
MEN1 O00255 1/20 0.56
HPGD P15428 1/20 0.56
RECQL P46063 1/20 0.56
HSD17B10 Q99714 1/20 0.56
USP2 O75604 1/20 0.43
LMNA P02545 1/20 0.43
HSPD1 P10809 1/20 0.42
BLM P54132 1/20 0.42
HSPE1 P61604 1/20 0.42
CTSK P43235 2/20 0.34
CTSS P25774 1/20 0.34
CA2 P00918 2/20 0.33
CA1 P00915 1/20 0.33
MAPK1 P28482 1/20 0.32
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL2423572 0.88 MEN1 (0.43) KMT2AMEN1HPGDRECQLHSD17B10
SCHEMBL2417844 0.87 MEN1 (0.42) KMT2AMEN1HPGDRECQLHSD17B10
SCHEMBL588170 0.86 HSPD1 (0.46) KMT2AMEN1HPGDRECQLHSD17B10
Ether SCHEMBL31356987 0.82 HSPD1 (0.41) KMT2AMEN1HPGDRECQLHSD17B10
SCHEMBL2423479 0.81 MEN1 (0.50) KMT2AMEN1HPGDRECQLHSD17B10
SCHEMBL29896815 0.81 HSPD1 (0.42) KMT2AMEN1HPGDRECQLHSD17B10
SCHEMBL3381545 0.79 HSPD1 (0.53) KMT2AMEN1HPGDRECQLHSD17B10
SCHEMBL31635350 0.78 HSPD1 (0.47) KMT2AMEN1HPGDRECQLHSD17B10
Triethyl Citrate SCHEMBL30689845 0.78 MEN1 (0.39) KMT2AMEN1HPGDRECQLHSD17B10
SCHEMBL2486881 0.77 HSPD1 (0.55) KMT2AMEN1HPGDRECQLHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1491523-B1 ESTER COMPOUND, PLASTICIZER FOR BIODEGRADABLE ALIPHATIC POLYESTER RESIN, AND BIODEGRADABLE RESIN COMPOSITION DAIHACHI CHEM IND (JP) 2011-09-14 EP claimed