SCHEMBL7631341

SCHEMBL7631341

[CH2]CCC[C](OOC(=O)c1cc(OC)cc(OC)c1)OOC(=O)c1cc(OC)cc(OC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.39
GAA P10253 2/20 0.39
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
ATM Q13315 1/20 0.37
RXRA P19793 1/20 0.37
HDAC3 O15379 1/20 0.36
HDAC4 P56524 1/20 0.36
HDAC1 Q13547 1/20 0.36
HDAC7 Q8WUI4 1/20 0.36
HDAC2 Q92769 1/20 0.36
HDAC10 Q969S8 1/20 0.36
HDAC11 Q96DB2 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
HDAC9 Q9UKV0 1/20 0.36
HDAC5 Q9UQL6 1/20 0.36
KMT2A Q03164 3/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
MAPT P10636 3/20 0.36

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
SCHEMBL7630431 0.95 HDAC3 (0.39) KDM4EGAANPC1RAB9AATM
SCHEMBL7630103 0.94 HDAC1 (0.40) KDM4EGAARXRAHDAC3HDAC4
SCHEMBL7628264 0.94 HDAC1 (0.40) KDM4EGAARXRAHDAC3HDAC4
SCHEMBL7632323 0.91 GAA (0.41) KDM4EGAANPC1RAB9AATM
SCHEMBL7630797 0.86 CES2 (0.50) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL7630674 0.85 CA1 (0.50) KDM4ENPC1RAB9AHDAC3HDAC4
SCHEMBL7629436 0.84 KDM4E (0.42) KDM4EGAANPC1RAB9AATM
SCHEMBL7630784 0.82 CES2 (0.49) NPC1RAB9AKMT2AMEN1SMN1; SMN2
SCHEMBL7629149 0.81 TPMT (0.37) NPC1RAB9ARXRAHDAC3HDAC4
SCHEMBL7628496 0.81 CES2 (0.48) NPC1RAB9AHDAC1HDAC6KMT2A

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