SCHEMBL7628575

SCHEMBL7628575

[CH2]COCCOC[C](OOC(=O)c1ccccc1OCC)OOC(=O)c1ccccc1OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
LMNA P02545 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
KDM4E B2RXH2 1/20 0.46
MAPT P10636 6/20 0.44
HCRTR1 O43613 2/20 0.44
HTT P42858 1/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
TSHR P16473 2/20 0.42
GLA P06280 1/20 0.41
KMT2A Q03164 2/20 0.40
PTK2B Q14289 1/20 0.40
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40
GAA P10253 1/20 0.40
MAPK1 P28482 1/20 0.40
HPGD P15428 1/20 0.39
HSD17B10 Q99714 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
MEN1 O00255 1/20 0.39

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
SCHEMBL7632115 0.94 HCRTR1 (0.47) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL7634280 0.87 NPC1 (0.42) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL7636943 0.83 HCRTR1 (0.51) ALDH1A1LMNAKDM4EMAPTHCRTR1
SCHEMBL7633679 0.82 MEN1 (0.40) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL6464181 0.81 HCRTR1 (0.62) ALDH1A1LMNAKDM4EMAPTHCRTR1
SCHEMBL7627538 0.80 CTSD (0.45) ALDH1A1LMNASMN1; SMN2MAPTHTT
SCHEMBL7626450 0.80 HCRTR1 (0.49) ALDH1A1LMNAKDM4EMAPTHCRTR1
SCHEMBL7633664 0.80 SCN1A (0.43) ALDH1A1SMN1; SMN2KMT2AMEN1
SCHEMBL7632714 0.79 KMT2A (0.48) ALDH1A1LMNASMN1; SMN2KDM4EMAPT
SCHEMBL7632782 0.78 HCRTR1 (0.53) ALDH1A1LMNAKDM4EMAPTHCRTR1

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