SCHEMBL7625932

SCHEMBL7625932

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

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
PKM P14618 1/20 0.38
MAPK1 P28482 1/20 0.38
HSD17B10 Q99714 1/20 0.38
POLB P06746 1/20 0.36
USP5 P45974 1/20 0.35
BCHE P06276 2/20 0.34
L3MBTL1 Q9Y468 2/20 0.34
PRSS1 P07477 1/20 0.34
ACR P10323 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.33
ALDH1A1 P00352 2/20 0.33
LMNA P02545 1/20 0.33
RXRA P19793 1/20 0.33
RXRB P28702 1/20 0.33
SCN1A P35498 1/20 0.33
SCN2A Q99250 1/20 0.33
SCN3A Q9NY46 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL7634279 0.97 MEN1 (0.39) MEN1KMT2APKMMAPK1HSD17B10
SCHEMBL7629525 0.94 PKM (0.40) MEN1KMT2APKMMAPK1HSD17B10
SCHEMBL7634658 0.87 ADRB2 (0.39) KMT2APKMMAPK1HSD17B10L3MBTL1
SCHEMBL7628397 0.86 ALDH1A1 (0.37) MEN1KMT2APKMMAPK1HSD17B10
SCHEMBL7633460 0.86 HSD17B10 (0.40) MEN1KMT2APKMMAPK1HSD17B10
SCHEMBL7630439 0.85 KMT2A (0.41) KMT2APKMMAPK1HSD17B10POLB
SCHEMBL7625638 0.85 CA1 (0.42) MEN1KMT2APKMSMN1; SMN2ALDH1A1
SCHEMBL7634823 0.85 ADRB2 (0.39) KMT2APKMMAPK1HSD17B10L3MBTL1
SCHEMBL7628984 0.84 LMNA (0.47) KMT2APKMMAPK1HSD17B10SMN1; SMN2
SCHEMBL7624871 0.84 PKM (0.34) PKMMAPK1HSD17B10

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