SCHEMBL7630709

SCHEMBL7630709

CC(C)(C)c1ccc(C(=O)OOC(=O)OCCC(COC(=O)OOC(=O)c2ccc(C(C)(C)C)cc2)C(COC(=O)OOC(=O)c2ccc(C(C)(C)C)cc2)C(COC(=O)OOC(=O)c2ccc(C(C)(C)C)cc2)C(CCOC(=O)OOC(=O)c2ccc(C(C)(C)C)cc2)COC(=O)OOC(=O)c2ccc(C(C)(C)C)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CA1 P00915 2/20 0.36
CA2 P00918 2/20 0.36
MAPT P10636 3/20 0.35
TDP1 Q9NUW8 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
BCHE P06276 2/20 0.35
MAPK1 P28482 2/20 0.35
HSD17B10 Q99714 2/20 0.35
ALDH1A1 P00352 2/20 0.35
LMNA P02545 1/20 0.35
ALOX15 P16050 1/20 0.35
APEX1 P27695 1/20 0.35
RECQL P46063 1/20 0.35
PKM P14618 1/20 0.34
TNF P01375 1/20 0.34
KLF5 Q13887 1/20 0.34
NOD1 Q9Y239 1/20 0.34
RAB9A P51151 3/20 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
SCHEMBL7632359 0.98 MEN1 (0.37) MEN1KMT2ACA1CA2MAPT
SCHEMBL7629633 0.86 CA1 (0.39) MEN1KMT2ACA1CA2MAPT
SCHEMBL7634823 0.86 ADRB2 (0.39) KMT2ACA2MAPTTDP1L3MBTL1
SCHEMBL7626179 0.85 BCHE (0.38) MEN1KMT2ACA1CA2MAPT
SCHEMBL7627390 0.85 ALDH1A1 (0.37) MEN1KMT2AMAPTTDP1L3MBTL1
SCHEMBL7634279 0.84 MEN1 (0.39) MEN1KMT2AMAPTL3MBTL1BCHE
SCHEMBL7626076 0.84 CA1 (0.42) MEN1KMT2ACA1CA2MAPT
SCHEMBL7634658 0.84 ADRB2 (0.39) KMT2ACA2MAPTTDP1L3MBTL1
SCHEMBL7631796 0.83 LMNA (0.47) KMT2ATDP1MAPK1HSD17B10ALDH1A1
SCHEMBL7630822 0.83 PKM (0.34) MAPK1HSD17B10PKM

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