SCHEMBL8662550

SCHEMBL8662550

CCCC(Oc1cccc(-c2ccccc2)c1)C(=O)NO

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.50
PPARA Q07869 3/20 0.50
CTSK P43235 1/20 0.48
RXRA P19793 2/20 0.48
RXRB P28702 2/20 0.48
HDAC8 Q9BY41 2/20 0.44
HDAC2 Q92769 2/20 0.44
HDAC3 O15379 1/20 0.44
HDAC4 P56524 1/20 0.44
HDAC1 Q13547 1/20 0.44
FFAR4 Q5NUL3 1/20 0.43
ERAP2 Q6P179 1/20 0.43
ERAP1 Q9NZ08 1/20 0.43
LNPEP Q9UIQ6 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
SCHEMBL8669614 0.89 PPARG (0.52) PPARGPPARACTSKHDAC8HDAC2
SCHEMBL10722124 0.81 PPARG (0.72) PPARGPPARAHDAC1
SCHEMBL7787176 0.76 ALDH1A1 (0.61)
SCHEMBL7787613 0.75 HDAC2 (0.43) PPARGPPARACTSKHDAC8HDAC2
SCHEMBL4529074 0.74 HDAC8 (0.46) RXRARXRBHDAC8HDAC2HDAC3
SCHEMBL6024266 0.74 PPARG (0.47) PPARGPPARA
SCHEMBL6746224 0.74 PPARG (0.54) PPARGPPARAHDAC8
SCHEMBL6298075 0.74 PPARG (0.54) PPARGPPARAHDAC8
SCHEMBL6841959 0.74 PPARG (0.54) PPARGPPARAHDAC8
SCHEMBL1258205 0.73 CYP2D6 (0.49) PPARGPPARA

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
EP-0874808-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES Abbott Laboratories (US) 1998-11-04 EP disclosed
WO-1997018188-A1 BIPHENYL HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 1997-05-22 WO disclosed