SCHEMBL7632007

SCHEMBL7632007

[CH2]COCCOC[C](OOC(=O)c1cccc(OC)c1)OOC(=O)c1cccc(OC)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES2 O00748 1/20 0.47
CES1 P23141 1/20 0.47
NPSR1 Q6W5P4 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ESR1 P03372 1/20 0.45
ESR2 Q92731 1/20 0.45
PARP1 P09874 1/20 0.44
NPC1 O15118 4/20 0.43
RAB9A P51151 3/20 0.43
POLB P06746 2/20 0.43
BLM P54132 1/20 0.43
TP53 P04637 1/20 0.42
CASP3 P42574 1/20 0.42
SENP8 Q96LD8 1/20 0.42
SENP7 Q9BQF6 1/20 0.42
SENP6 Q9GZR1 1/20 0.42
GAA P10253 1/20 0.41
MAPT P10636 1/20 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
SCHEMBL7631144 0.94 CES2 (0.50) CES2CES1NPSR1SMN1; SMN2MEN1
SCHEMBL7626336 0.88 KMT2A (0.44) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL7628033 0.87 L3MBTL1 (0.37) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL7635393 0.85 NPC1 (0.44) MEN1KMT2AESR1ESR2PARP1
SCHEMBL7633259 0.84 CA1 (0.46) CES2CES1NPSR1SMN1; SMN2MEN1
SCHEMBL7632759 0.83 CES2 (0.56) CES2CES1NPSR1SMN1; SMN2MEN1
SCHEMBL7627403 0.81 LMNA (0.53) SMN1; SMN2KMT2ANPC1RAB9APOLB
SCHEMBL7625128 0.81 KMT2A (0.47) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL7625731 0.81 MAPT (0.50) SMN1; SMN2MEN1KMT2ANPC1RAB9A
SCHEMBL7628767 0.81 KMO (0.42) NPC1RAB9AMAPT

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-1233014-A1 ASYMMETRIC ORGANIC PEROXIDE, CROSSLINKING AGENT COMPRISING THE SAME, AND METHOD OF CROSSLINKING WITH THE SAME NOF CORPORATION (JP) 2002-08-21 EP disclosed