SCHEMBL7044733

SCHEMBL7044733

O=C(O)CCCCOc1cccc(-c2ccccc2)c1

nearest known ligand 0.72

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 4/20 0.72
FFAR1 O14842 2/20 0.72
HDAC1 Q13547 3/20 0.70
HDAC2 Q92769 3/20 0.70
HDAC3 O15379 2/20 0.62
HDAC4 P56524 2/20 0.62
HDAC7 Q8WUI4 2/20 0.62
HDAC10 Q969S8 2/20 0.62
HDAC11 Q96DB2 2/20 0.62
HDAC8 Q9BY41 2/20 0.62
HDAC6 Q9UBN7 2/20 0.62
HDAC9 Q9UKV0 2/20 0.62
HDAC5 Q9UQL6 2/20 0.62
FABP1 P07148 1/20 0.62
LTB4R Q15722 4/20 0.57
HRH3 Q9Y5N1 4/20 0.56
PPARA Q07869 2/20 0.56
MRGPRX4 Q96LA9 1/20 0.55

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
SCHEMBL8355650 0.98 HDAC1 (0.72) FFAR4FFAR1HDAC1HDAC2HDAC3
SCHEMBL7365315 0.98 HDAC1 (0.72) FFAR4FFAR1HDAC1HDAC2HDAC3
SCHEMBL7046130 0.95 FFAR4 (0.78) FFAR4FFAR1HDAC1HDAC2HDAC3
SCHEMBL7049369 0.90 FFAR4 (0.67) FFAR4FFAR1HDAC1HDAC2HDAC3
SCHEMBL8987102 0.87 LTB4R (0.64) FFAR4FFAR1HDAC1HDAC2HDAC3
SCHEMBL30639265 0.86 PPARA (0.58) FFAR4FFAR1HDAC1HDAC2FABP1
SCHEMBL7367452 0.86 HDAC1 (0.69) FFAR4FFAR1HDAC1HDAC2HDAC3
SCHEMBL7044798 0.85 HDAC1 (0.64) FFAR4FFAR1HDAC1HDAC2HDAC3
SCHEMBL7044760 0.85 HDAC1 (0.74) HDAC1HDAC2HDAC3HDAC4HDAC7
SCHEMBL1162023 0.84 PPARA (0.74) FFAR4FFAR1HDAC1HDAC2HDAC3

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