SCHEMBL7633858

SCHEMBL7633858

COc1ccc(OC)c(C(=O)OOC(=O)OCCC(COC(=O)OOC(=O)c2cc(OC)ccc2OC)C(COC(=O)OOC(=O)c2cc(OC)ccc2OC)C(COC(=O)OOC(=O)c2cc(OC)ccc2OC)C(CCOC(=O)OOC(=O)c2cc(OC)ccc2OC)COC(=O)OOC(=O)c2cc(OC)ccc2OC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
MAPT P10636 3/20 0.41
HTT P42858 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
TSHR P16473 4/20 0.40
KDM4E B2RXH2 3/20 0.40
ABCG2 Q9UNQ0 1/20 0.40
HSD11B1 P28845 1/20 0.39
ALDH1A1 P00352 5/20 0.39
HSD17B10 Q99714 2/20 0.39
TP53 P04637 1/20 0.39
GLA P06280 1/20 0.39
PDE4A P27815 1/20 0.38
PDE4B Q07343 1/20 0.38
PDE4C Q08493 1/20 0.38
PDE4D Q08499 1/20 0.38
POLB P06746 1/20 0.38
LMNA P02545 3/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL7630030 0.98 MEN1 (0.43) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL7635469 0.94 MEN1 (0.45) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL7670442 0.91 KMT2A (0.46) MEN1KMT2AHTTTP53LMNA
SCHEMBL7631903 0.89 KMT2A (0.46) MEN1KMT2AHTTTP53LMNA
SCHEMBL7634810 0.87 MEN1 (0.45) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL7630234 0.86 KMT2A (0.48) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL7631029 0.85 ALDH1A1 (0.41) MEN1KMT2AMAPTHTTNPSR1
SCHEMBL7627511 0.85 KMT2A (0.48) MEN1KMT2AMAPTHTTALDH1A1
SCHEMBL7633532 0.84 KMT2A (0.48) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL7629505 0.83 PKM (0.40) MEN1KMT2AMAPTALDH1A1PDE4D

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