SCHEMBL7634280

SCHEMBL7634280

[CH2]COCCOC[C](OOC(=O)c1ccccc1OC)OOC(=O)c1ccccc1OC

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 2/20 0.42
RAB9A P51151 1/20 0.42
CTSD P07339 1/20 0.42
ALDH1A1 P00352 4/20 0.42
HTT P42858 3/20 0.42
L3MBTL1 Q9Y468 2/20 0.42
KMT2A Q03164 2/20 0.42
LMNA P02545 6/20 0.42
SMN1; SMN2 Q16637 4/20 0.42
KDM4E B2RXH2 1/20 0.41
HPGD P15428 2/20 0.41
MAPT P10636 3/20 0.41
NPSR1 Q6W5P4 2/20 0.41
HSP90AA1 P07900 1/20 0.41
ATM Q13315 1/20 0.40
ESR1 P03372 1/20 0.39
ESR2 Q92731 1/20 0.39
XBP1 P17861 1/20 0.39
GAA P10253 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
SCHEMBL7627538 0.93 CTSD (0.45) NPC1RAB9ACTSDALDH1A1HTT
SCHEMBL7632714 0.89 KMT2A (0.48) NPC1RAB9AALDH1A1L3MBTL1KMT2A
SCHEMBL7628575 0.87 ALDH1A1 (0.46) ALDH1A1HTTL3MBTL1KMT2ALMNA
SCHEMBL7633410 0.85 CA12 (0.41) ALDH1A1L3MBTL1KMT2ALMNASMN1; SMN2
SCHEMBL7632836 0.85 MEN1 (0.47) RAB9AALDH1A1HTTKMT2ALMNA
SCHEMBL7633679 0.84 MEN1 (0.40) NPC1RAB9AALDH1A1L3MBTL1KMT2A
SCHEMBL7634449 0.84 KMT2A (0.52) NPC1RAB9AALDH1A1HTTL3MBTL1
SCHEMBL7627280 0.83 KMT2A (0.49) ALDH1A1HTTKMT2AKDM4EMAPT
SCHEMBL7632879 0.82 PKM (0.43) NPC1RAB9AALDH1A1L3MBTL1KMT2A
SCHEMBL7629591 0.82 CTSD (0.50) NPC1RAB9ACTSDALDH1A1HTT

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