SCHEMBL7627280

SCHEMBL7627280

[CH2]COCCOC[C](OOC(=O)c1cc(OC)c(OC)cc1OC)OOC(=O)c1cc(OC)c(OC)cc1OC

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
CYP3A4 P08684 1/20 0.40
PAX8 Q06710 1/20 0.39
ALDH1A1 P00352 3/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
HTT P42858 1/20 0.36
MEN1 O00255 3/20 0.35
KDM4E B2RXH2 1/20 0.35
HMGCR P04035 1/20 0.34

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
SCHEMBL7626261 0.93 KMT2A (0.49) KMT2ACYP3A4PAX8ALDH1A1GAA
SCHEMBL7632836 0.86 MEN1 (0.47) KMT2AALDH1A1MAPTHTTMEN1
SCHEMBL7634449 0.85 KMT2A (0.52) KMT2AALDH1A1MAPTHTTMEN1
SCHEMBL7634280 0.83 NPC1 (0.42) KMT2AALDH1A1GAAMAPTHTT
SCHEMBL7625731 0.82 MAPT (0.50) KMT2ACYP3A4ALDH1A1GAAMAPT
SCHEMBL7632879 0.81 PKM (0.43) KMT2AALDH1A1MAPTPKMMEN1
SCHEMBL7636514 0.80 SLC29A1 (0.44) KMT2ACYP3A4MAPTPKMMEN1
SCHEMBL7632714 0.80 KMT2A (0.48) KMT2AALDH1A1GAAMAPTMEN1
SCHEMBL7633410 0.78 CA12 (0.41) KMT2AALDH1A1GAAMEN1
SCHEMBL7630288 0.78 MEN1 (0.50) KMT2AALDH1A1MAPTHTTMEN1

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