SCHEMBL7634178

SCHEMBL7634178

CCCC(COC(=O)OOC(=O)c1ccccc1OCC)(COC(=O)OOC(=O)c1ccccc1OCC)COC(=O)OOC(=O)c1ccccc1OCC

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 2/20 0.44
KMT2A Q03164 3/20 0.41
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 2/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
MEN1 O00255 2/20 0.39
POLB P06746 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
TSHR P16473 2/20 0.39
TP53 P04637 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
GLA P06280 1/20 0.38

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
SCHEMBL7629577 0.92 HCRTR1 (0.48) HCRTR1KMT2AESR1ESR2L3MBTL1
SCHEMBL7628510 0.91 HCRTR1 (0.47) HCRTR1KMT2AESR1ESR2L3MBTL1
SCHEMBL7624304 0.89 NPC1 (0.47) KMT2AESR1ESR2L3MBTL1ALDH1A1
SCHEMBL7628244 0.86 HCRTR1 (0.47) HCRTR1KMT2AESR1ESR2L3MBTL1
SCHEMBL7633069 0.83 TSHR (0.41) KMT2AL3MBTL1ALDH1A1MAPTGAA
SCHEMBL7631737 0.82 SCN1A (0.47) KMT2AALDH1A1MAPK1MEN1SMN1; SMN2
SCHEMBL6464181 0.81 HCRTR1 (0.62) HCRTR1KMT2AESR1ESR2L3MBTL1
SCHEMBL7631858 0.81 KMT2A (0.47) KMT2AALDH1A1GAAMEN1POLB
SCHEMBL7632033 0.79 NPC1 (0.50) KMT2AESR1ESR2L3MBTL1ALDH1A1
SCHEMBL7626184 0.79 NPC1 (0.49) KMT2AESR1ESR2L3MBTL1ALDH1A1

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