SCHEMBL6135712

SCHEMBL6135712

O=CN(O)CCCCC(=O)O

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC2 Q92769 7/20 0.51
HDAC8 Q9BY41 7/20 0.51
HDAC6 Q9UBN7 6/20 0.51
HDAC1 Q13547 5/20 0.51
HDAC3 O15379 3/20 0.51
HDAC4 P56524 3/20 0.51
HDAC7 Q8WUI4 3/20 0.51
HDAC10 Q969S8 3/20 0.51
HDAC11 Q96DB2 3/20 0.51
HDAC9 Q9UKV0 3/20 0.51
HDAC5 Q9UQL6 3/20 0.51
LMNA P02545 2/20 0.50
NFKB1 P19838 2/20 0.48
TSHR P16473 1/20 0.48
PMP22 Q01453 1/20 0.48
GPR84 Q9NQS5 1/20 0.46
FFAR1 O14842 1/20 0.46
FFAR4 Q5NUL3 1/20 0.46
CAMK2A Q9UQM7 1/20 0.44
SLC22A6 Q4U2R8 1/20 0.43

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
SCHEMBL16792232 0.93 CAMK2A (0.46) HDAC2HDAC8HDAC6HDAC1HDAC3
SCHEMBL4825533 0.80 HDAC2 (0.50) HDAC2HDAC8HDAC6HDAC1HDAC3
SCHEMBL6941914 0.74 HDAC2 (0.41) HDAC2HDAC8HDAC6HDAC1HDAC3
SCHEMBL28798395 0.73 TSHR (0.63) HDAC11LMNANFKB1TSHRPMP22
Adipic Acid SCHEMBL28091043 0.72 LMNA (0.73) HDAC11LMNANFKB1TSHRPMP22
SCHEMBL12450514 0.71 LMNA (0.48) HDAC2HDAC8HDAC6HDAC1HDAC3
Adipic Acid SCHEMBL8941691 0.71 LMNA (1.00) HDAC11LMNANFKB1TSHRPMP22
Adipic Acid SCHEMBL1330953 0.71 LMNA (1.00) HDAC11LMNANFKB1TSHRPMP22
Adipic Acid SCHEMBL4930 0.71 LMNA (1.00) HDAC11LMNANFKB1TSHRPMP22
Adipic Acid SCHEMBL2244299 0.71 LMNA (1.00) HDAC11LMNANFKB1TSHRPMP22

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6908911-B1 Antibacterial agents BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2005-06-21 US claimed
EP-1210330-B1 ANTIBACTERIAL AGENTS VERNALIS OXFORD LTD (GB) 2005-04-20 EP claimed
EP-1210330-A1 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2002-06-05 EP claimed
WO-2001010835-A1 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-02-15 WO claimed
US-6908911-B1 Antibacterial agents BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2005-06-21 US disclosed
EP-1210330-B1 ANTIBACTERIAL AGENTS VERNALIS OXFORD LTD (GB) 2005-04-20 EP disclosed
EP-1210330-A1 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2002-06-05 EP disclosed
WO-2001010835-A1 ANTIBACTERIAL AGENTS BRITISH BIOTECH PHARMACEUTICALS LIMITED (GB) 2001-02-15 WO disclosed