SCHEMBL7630747

SCHEMBL7630747

[CH2]CCCCCCC[C](OOC(=O)c1cccc(C)c1)OOC(=O)c1cccc(C)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC8 Q9BY41 2/20 0.43
HDAC6 Q9UBN7 2/20 0.43
HDAC3 O15379 1/20 0.43
HDAC4 P56524 1/20 0.43
HDAC1 Q13547 1/20 0.43
HDAC7 Q8WUI4 1/20 0.43
HDAC2 Q92769 1/20 0.43
HDAC10 Q969S8 1/20 0.43
HDAC11 Q96DB2 1/20 0.43
HDAC9 Q9UKV0 1/20 0.43
HDAC5 Q9UQL6 1/20 0.43
PARP1 P09874 1/20 0.41
CTNNB1 P35222 1/20 0.40
WNT3A P56704 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
ESR1 P03372 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
POLB P06746 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
SCHEMBL7630897 1.00 HDAC8 (0.43) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL7631423 1.00 HDAC8 (0.43) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL7633414 1.00 HDAC8 (0.43) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL7628781 1.00 HDAC8 (0.43) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL7631609 1.00 HDAC8 (0.43) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL7631928 0.99 PARP1 (0.41) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL7627807 0.96 PARP1 (0.44) HDAC8HDAC6PARP1CTNNB1WNT3A
SCHEMBL7628461 0.89 PARP1 (0.45) HDAC8HDAC6PARP1CTNNB1WNT3A
SCHEMBL7633001 0.84 HDAC3 (0.37) HDAC8HDAC6HDAC3HDAC4HDAC1
SCHEMBL7633394 0.84 CES2 (0.48) HDAC6HDAC1PARP1NPC1RAB9A

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