SCHEMBL7632033

SCHEMBL7632033

CCC(COC(=O)OOC(=O)c1ccccc1OC)(COC(=O)OOC(=O)c1ccccc1OC)COC(=O)OOC(=O)c1ccccc1OC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.50
RAB9A P51151 1/20 0.50
CTSD P07339 1/20 0.44
ALDH1A1 P00352 4/20 0.44
MAPT P10636 4/20 0.44
NPSR1 Q6W5P4 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.44
KMT2A Q03164 2/20 0.44
HTT P42858 2/20 0.44
HPGD P15428 4/20 0.43
ATM Q13315 1/20 0.41
GAA P10253 3/20 0.41
LMNA P02545 1/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
XBP1 P17861 1/20 0.41
HSP90AA1 P07900 1/20 0.40
TSHR P16473 1/20 0.40
MAPK1 P28482 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL7626184 0.94 NPC1 (0.49) NPC1RAB9ACTSDALDH1A1MAPT
SCHEMBL7624304 0.91 NPC1 (0.47) NPC1RAB9ACTSDALDH1A1MAPT
SCHEMBL7628546 0.90 KMT2A (0.49) NPC1RAB9AALDH1A1KMT2AHTT
SCHEMBL7628510 0.88 HCRTR1 (0.47) ALDH1A1MAPTNPSR1L3MBTL1KMT2A
SCHEMBL7630256 0.87 NPC1 (0.48) NPC1RAB9ACTSDALDH1A1MAPT
SCHEMBL2612526 0.87 NPC1 (0.56) NPC1RAB9ACTSDALDH1A1MAPT
SCHEMBL7630311 0.86 CA12 (0.42) NPC1RAB9AALDH1A1NPSR1L3MBTL1
SCHEMBL7635526 0.84 KMT2A (0.50) NPC1RAB9AALDH1A1MAPTL3MBTL1
SCHEMBL7626030 0.84 MEN1 (0.47) RAB9AALDH1A1MAPTNPSR1L3MBTL1
SCHEMBL7629577 0.83 HCRTR1 (0.48) ALDH1A1MAPTNPSR1L3MBTL1KMT2A

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