SCHEMBL8524199

SCHEMBL8524199

CCCC(C=Cc1ccccc1)=C(C=CC(=O)O)C(=O)O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 3/20 0.51
HDAC4 P56524 2/20 0.51
HDAC1 Q13547 2/20 0.51
HDAC2 Q92769 2/20 0.51
HDAC8 Q9BY41 2/20 0.51
HDAC6 Q9UBN7 2/20 0.51
TNKS O95271 1/20 0.51
HCAR2 Q8TDS4 1/20 0.51
HDAC7 Q8WUI4 1/20 0.51
HDAC10 Q969S8 1/20 0.51
HDAC11 Q96DB2 1/20 0.51
TNKS2 Q9H2K2 1/20 0.51
HDAC9 Q9UKV0 1/20 0.51
HDAC5 Q9UQL6 1/20 0.51
NPC1 O15118 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
GLA P06280 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
ALDH1A1 P00352 4/20 0.44
HAO1 Q9UJM8 1/20 0.44

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
SCHEMBL987787 0.92 HDAC3 (0.49) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL6635732 0.88 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL17065129 0.84 HDAC3 (0.50) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL8526405 0.82 HDAC3 (0.55) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL14351521 0.80 GLA (0.53) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL3806310 0.80 TDP1 (0.52) HDAC3HDAC4HDAC1HDAC2HDAC8
Cinnamic Acid SCHEMBL29010571 0.78 HDAC3 (0.68) HDAC3HDAC4HDAC1HDAC2HDAC8
Cinnamic Acid SCHEMBL4613502 0.77 HDAC3 (0.79) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL3430615 0.77 HDAC3 (0.44) HDAC3HDAC4HDAC1HDAC2HDAC8
SCHEMBL3970920 0.76 HDAC3 (0.60) HDAC3HDAC4HDAC1HDAC2HDAC8

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
US-5869215-A Toner compositions and processes thereof XEROX CORPORATION (US) 1999-02-09 US disclosed