SCHEMBL4783831

SCHEMBL4783831

Cl[Si](Cl)(Cl)CCCCCOc1ccc(-c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC3 O15379 10/20 0.54
HDAC4 P56524 10/20 0.54
HDAC1 Q13547 10/20 0.54
HDAC7 Q8WUI4 10/20 0.54
HDAC2 Q92769 10/20 0.54
HDAC10 Q969S8 10/20 0.54
HDAC11 Q96DB2 10/20 0.54
HDAC8 Q9BY41 10/20 0.54
HDAC6 Q9UBN7 10/20 0.54
HDAC9 Q9UKV0 10/20 0.54
HDAC5 Q9UQL6 10/20 0.54
LSS P48449 1/20 0.51
HRH3 Q9Y5N1 5/20 0.51
KCNH2 Q12809 1/20 0.51
HRH4 Q9H3N8 1/20 0.51
KCNA3 P22001 1/20 0.50
KDM4E B2RXH2 1/20 0.47
MEN1 O00255 1/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47

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
SCHEMBL5574693 1.00 HDAC3 (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10620158 0.93 LSS (0.54) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17476329 0.89 KCNA3 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17476367 0.89 KCNA3 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17476377 0.89 KCNA3 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17476338 0.89 KCNA3 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL17476375 0.89 KCNA3 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL1497968 0.89 KCNA3 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL2685625 0.89 KCNA3 (0.64) HDAC3HDAC4HDAC1HDAC7HDAC2
SCHEMBL10682923 0.82 HDAC1 (0.60) HDAC3HDAC4HDAC1HDAC7HDAC2

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
WO-2008063134-A1 METHOD OF PRODUCING A PATTERN OF DISCRIMINATIVE WETTABILITY AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2008-05-29 WO disclosed