SCHEMBL7044798

SCHEMBL7044798

COC(=O)CCCCOc1cccc(-c2ccccc2)c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 11/20 0.64
HDAC2 Q92769 11/20 0.64
LTB4R Q15722 1/20 0.58
HDAC8 Q9BY41 9/20 0.57
HDAC6 Q9UBN7 9/20 0.57
HDAC3 O15379 6/20 0.57
HDAC4 P56524 6/20 0.57
HDAC7 Q8WUI4 6/20 0.57
HDAC10 Q969S8 6/20 0.57
HDAC11 Q96DB2 6/20 0.57
HDAC9 Q9UKV0 6/20 0.57
HDAC5 Q9UQL6 6/20 0.57
FFAR1 O14842 2/20 0.54
FFAR4 Q5NUL3 2/20 0.54
HRH3 Q9Y5N1 5/20 0.52

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
SCHEMBL7049254 0.87 HDAC1 (0.72) HDAC1HDAC2LTB4RHDAC8HDAC6
SCHEMBL6335494 0.86 HDAC1 (0.63) HDAC1HDAC2LTB4RHDAC8HDAC6
SCHEMBL14539300 0.85 HDAC1 (0.74) HDAC1HDAC2LTB4RHDAC8HDAC6
SCHEMBL7044733 0.85 FFAR4 (0.72) HDAC1HDAC2LTB4RHDAC8HDAC6
SCHEMBL7370657 0.85 HDAC1 (0.63) HDAC1HDAC2HDAC8HDAC6HDAC3
SCHEMBL25270797 0.85 HDAC1 (0.66) HDAC1HDAC2LTB4RHDAC8HDAC6
SCHEMBL10944790 0.85 HDAC1 (0.66) HDAC1HDAC2LTB4RHDAC8HDAC6
SCHEMBL839640 0.85 HDAC1 (0.66) HDAC1HDAC2LTB4RHDAC8HDAC6
SCHEMBL8355650 0.84 HDAC1 (0.72) HDAC1HDAC2LTB4RHDAC8HDAC6
SCHEMBL7365315 0.84 HDAC1 (0.72) HDAC1HDAC2LTB4RHDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0874808-B1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LAB (US) 2003-04-09 EP disclosed
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 EP disclosed
US-5665777-A ANTIINFLAMMATORY AGENTS ABBOTT LABORATORIES (US) 1997-09-09 US disclosed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 WO disclosed