SCHEMBL7048950

SCHEMBL7048950

O=C(CCOc1ccc(-c2ccc(F)cc2)cc1)NO

nearest known ligand 0.90

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 4/20 0.74
MMP1 P03956 1/20 0.68
MMP2 P08253 1/20 0.68
MMP9 P14780 1/20 0.68
MMP13 P45452 1/20 0.68
HDAC1 Q13547 2/20 0.60
HDAC2 Q92769 2/20 0.60
HDAC3 O15379 1/20 0.60
HDAC4 P56524 1/20 0.60
HDAC7 Q8WUI4 1/20 0.60
HDAC10 Q969S8 1/20 0.60
HDAC11 Q96DB2 1/20 0.60
HDAC8 Q9BY41 1/20 0.60
HDAC6 Q9UBN7 1/20 0.60
HDAC9 Q9UKV0 1/20 0.60
HDAC5 Q9UQL6 1/20 0.60
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
SCHEMBL7041930 0.91 HDAC1 (0.74) MMP3MMP1MMP2MMP9MMP13
SCHEMBL7044763 0.85 MMP3 (1.00) MMP3MMP1MMP2MMP9MMP13
SCHEMBL7046807 0.84 MMP3 (0.74) MMP3MMP1MMP2MMP9MMP13
SCHEMBL2680423 0.81 MMP3 (1.00) MMP3MMP1MMP2MMP9MMP13
SCHEMBL7045826 0.79 HDAC1 (0.58) MMP3HDAC1HDAC2HDAC3HDAC4
SCHEMBL7043273 0.78 MMP3 (0.77) MMP3MMP1MMP2MMP9MMP13
SCHEMBL7048468 0.78 HDAC1 (0.64) MMP3HDAC1HDAC2HDAC3HDAC4
SCHEMBL4773749 0.78 MMP3 (0.81) MMP3MMP1MMP2MMP9MMP13
SCHEMBL1257639 0.78 LMNA (0.63)
SCHEMBL7044856 0.77 HDAC1 (0.88) MMP3MMP1MMP2MMP9MMP13

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