SCHEMBL7624304

SCHEMBL7624304

CCCC(COC(=O)OOC(=O)c1ccccc1OC)(COC(=O)OOC(=O)c1ccccc1OC)COC(=O)OOC(=O)c1ccccc1OC

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.47
RAB9A P51151 1/20 0.47
CTSD P07339 1/20 0.41
ALDH1A1 P00352 6/20 0.41
MAPT P10636 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HTT P42858 2/20 0.41
KMT2A Q03164 1/20 0.41
HPGD P15428 2/20 0.40
MAPK1 P28482 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ATM Q13315 1/20 0.39
GAA P10253 2/20 0.39
LMNA P02545 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
XBP1 P17861 1/20 0.39

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
SCHEMBL7632033 0.91 NPC1 (0.50) NPC1RAB9ACTSDALDH1A1MAPT
SCHEMBL7626184 0.91 NPC1 (0.49) NPC1RAB9ACTSDALDH1A1MAPT
SCHEMBL7631858 0.89 KMT2A (0.47) NPC1RAB9AALDH1A1HTTKMT2A
SCHEMBL7634178 0.89 HCRTR1 (0.44) ALDH1A1MAPTL3MBTL1NPSR1KMT2A
SCHEMBL7625431 0.86 CA12 (0.41) ALDH1A1L3MBTL1NPSR1KMT2ASMN1; SMN2
SCHEMBL7633069 0.84 TSHR (0.41) NPC1RAB9AALDH1A1MAPTL3MBTL1
SCHEMBL7630483 0.84 MEN1 (0.45) RAB9AALDH1A1MAPTNPSR1HTT
SCHEMBL7631538 0.84 KMT2A (0.48) NPC1RAB9AALDH1A1MAPTL3MBTL1
SCHEMBL7630256 0.84 NPC1 (0.48) NPC1RAB9ACTSDALDH1A1MAPT
SCHEMBL7631737 0.84 SCN1A (0.47) ALDH1A1KMT2AMAPK1SMN1; SMN2LMNA

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