SCHEMBL16619261

SCHEMBL16619261

C=C(C=CC(=O)O)C(=O)OCCO.C=CC=CC=Cc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.39
HDAC3 O15379 2/20 0.39
HDAC4 P56524 2/20 0.39
HDAC1 Q13547 2/20 0.39
HDAC7 Q8WUI4 2/20 0.39
HDAC2 Q92769 2/20 0.39
HDAC10 Q969S8 2/20 0.39
HDAC11 Q96DB2 2/20 0.39
HDAC8 Q9BY41 2/20 0.39
HDAC6 Q9UBN7 2/20 0.39
HDAC9 Q9UKV0 2/20 0.39
HDAC5 Q9UQL6 2/20 0.39
TNKS O95271 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
POLB P06746 1/20 0.36
AKR1B10 O60218 1/20 0.36
AKR1B1 P15121 1/20 0.36
KDM4E B2RXH2 2/20 0.35
MAOB P27338 3/20 0.35
LMNA P02545 3/20 0.35

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
SCHEMBL8181765 0.87 MEN1 (0.46) HCAR2HDAC3HDAC4HDAC1HDAC7
SCHEMBL8171290 0.84 POLB (0.40) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL11047711 0.82 AKR1B10 (0.48) HCAR2HDAC3HDAC4HDAC1HDAC7
Maleic Acid SCHEMBL2777446 0.80 HDAC3 (0.59) HCAR2HDAC3HDAC4HDAC1HDAC7
SCHEMBL7625573 0.80 TSHR (0.53) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL6756945 0.80 MEN1 (0.51) HCAR2HDAC3HDAC4HDAC1HDAC7
SCHEMBL9161907 0.77 TSHR (0.42) HCAR2
Juarezic Acid SCHEMBL2142973 0.76 TSHR (0.51) HCAR2HDAC3HDAC4HDAC1HDAC7
Juarezic Acid SCHEMBL417723 0.76 HDAC3 (0.57) HCAR2HDAC3HDAC4HDAC1HDAC7
Ethyl Fumarate SCHEMBL251387 0.75 HCAR2 (0.53) HCAR2HDAC3HDAC4HDAC1HDAC7

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3052558-A1 COMPOSITION, KIT, AND METHOD FOR THE PRODUCTION OF LATEX FOAM EOC Belgium NV (BE) 2016-08-10 EP disclosed
WO-2015049641-A1 COMPOSITION, KIT, AND METHOD FOR THE PRODUCTION OF LATEX FOAM EOC BELGIUM NV (BE) 2015-04-09 WO disclosed