SCHEMBL9541227

SCHEMBL9541227

COC(=O)CCCC(=O)c1ccc(OC)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.73
HDAC8 Q9BY41 4/20 0.65
HDAC1 Q13547 4/20 0.65
MMP1 P03956 1/20 0.61
MAPT P10636 2/20 0.60
KMT2A Q03164 1/20 0.58
NPC1 O15118 2/20 0.57
RAB9A P51151 1/20 0.57
HDAC3 O15379 2/20 0.56
HDAC4 P56524 2/20 0.56
HDAC7 Q8WUI4 2/20 0.56
HDAC2 Q92769 2/20 0.56
HDAC10 Q969S8 2/20 0.56
HDAC11 Q96DB2 2/20 0.56
HDAC6 Q9UBN7 2/20 0.56
HDAC9 Q9UKV0 2/20 0.56
HDAC5 Q9UQL6 2/20 0.56
GSK3B P49841 1/20 0.56
L3MBTL1 Q9Y468 1/20 0.54
ALDH1A1 P00352 2/20 0.53

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
SCHEMBL6160043 0.95 HDAC8 (0.72) PDE4BHDAC8HDAC1MMP1MAPT
SCHEMBL4082864 0.91 PDE4B (0.86) PDE4BHDAC8HDAC1MMP1MAPT
SCHEMBL1108994 0.89 MMP1 (0.70) PDE4BHDAC8HDAC1MMP1MAPT
SCHEMBL3171960 0.87 PDE4B (0.79) PDE4BHDAC8HDAC1MMP1MAPT
SCHEMBL5269091 0.85 PDE4B (0.67) PDE4BHDAC8HDAC1MMP1MAPT
SCHEMBL11281722 0.84 PDE4B (0.70) PDE4BHDAC8HDAC1MMP1MAPT
SCHEMBL7995333 0.84 PDE4B (0.75) PDE4BHDAC8HDAC1MMP1MAPT
SCHEMBL99448 0.84 PDE4B (1.00) PDE4BHDAC8HDAC1MMP1MAPT
SCHEMBL28440147 0.84 PDE4B (0.56) PDE4BHDAC8HDAC1MAPTKMT2A
SCHEMBL14960046 0.84 PDE4B (0.75) PDE4BHDAC8HDAC1MMP1MAPT

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
JP-5170696-A None JP disclosed
JP-H05170696-A BIS(4-ALKOXYPHENYL)ETHYLENE DERIVATIVE HOKURIKU SEIYAKU CO LTD 1993-07-09 JP disclosed