SCHEMBL7626261

SCHEMBL7626261

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

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
CYP3A4 P08684 1/20 0.42
PAX8 Q06710 1/20 0.41
ALDH1A1 P00352 3/20 0.40
GAA P10253 1/20 0.40
HTT P42858 1/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
MEN1 O00255 3/20 0.38
KDM4E B2RXH2 1/20 0.37
HMGCR P04035 1/20 0.36
RAB9A P51151 1/20 0.35

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
SCHEMBL7627280 0.93 KMT2A (0.49) KMT2ACYP3A4PAX8ALDH1A1GAA
SCHEMBL7630288 0.85 MEN1 (0.50) KMT2AALDH1A1HTTMAPTMEN1
SCHEMBL7624885 0.83 KMT2A (0.55) KMT2AALDH1A1HTTMAPTMEN1
SCHEMBL7627538 0.81 CTSD (0.45) KMT2AALDH1A1GAAHTTMAPT
SCHEMBL7632168 0.80 MAPT (0.54) KMT2ACYP3A4ALDH1A1GAAMAPT
SCHEMBL7636384 0.80 KMT2A (0.56) KMT2ACYP3A4PAX8ALDH1A1GAA
SCHEMBL7630793 0.79 KMT2A (0.53) KMT2ACYP3A4PAX8ALDH1A1GAA
SCHEMBL7627571 0.79 PKM (0.45) KMT2AALDH1A1MAPTPKMMEN1
SCHEMBL7632836 0.79 MEN1 (0.47) KMT2AALDH1A1HTTMAPTMEN1
SCHEMBL7627687 0.78 SMN1; SMN2 (0.45) KMT2AMAPTPKMMEN1KDM4E

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