SCHEMBL7047876

SCHEMBL7047876

O=C(CCOc1cccc(-c2ccccc2)c1)NO

nearest known ligand 0.75

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 3/20 0.75
HDAC1 Q13547 10/20 0.62
HDAC2 Q92769 10/20 0.62
HDAC8 Q9BY41 7/20 0.62
HDAC6 Q9UBN7 7/20 0.62
HDAC3 O15379 4/20 0.61
HDAC4 P56524 4/20 0.61
HDAC7 Q8WUI4 4/20 0.61
HDAC10 Q969S8 4/20 0.61
HDAC11 Q96DB2 4/20 0.61
HDAC9 Q9UKV0 4/20 0.61
HDAC5 Q9UQL6 4/20 0.61
MMP1 P03956 1/20 0.54
MMP2 P08253 1/20 0.54
MMP9 P14780 1/20 0.54
MMP13 P45452 1/20 0.54
FFAR1 O14842 1/20 0.53
FFAR4 Q5NUL3 1/20 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
SCHEMBL7047498 0.93 HDAC1 (0.68) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL7044760 0.91 HDAC1 (0.74) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL7044763 0.86 MMP3 (1.00) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL4773749 0.85 MMP3 (0.81) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL404889 0.84 KMT2A (0.54) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL27997601 0.84 KMT2A (0.54) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL7049369 0.84 FFAR4 (0.67) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL7045826 0.82 HDAC1 (0.58) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL7048468 0.81 HDAC1 (0.64) MMP3HDAC1HDAC2HDAC8HDAC6
SCHEMBL7046130 0.80 FFAR4 (0.78) HDAC1HDAC2HDAC8HDAC6HDAC3

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 7 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
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