SCHEMBL6825866

SCHEMBL6825866

COc1ccc(S(=O)(=O)C(CC(=O)NO)Cc2ccc(OCc3ccccc3)cc2)cc1

nearest known ligand 0.85

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 13/20 0.85
MMP1 P03956 12/20 0.85
MMP3 P08254 11/20 0.85
PDE4A P27815 10/20 0.85
PDE4B Q07343 10/20 0.85
PDE4C Q08493 10/20 0.85
PDE4D Q08499 10/20 0.85
MMP9 P14780 3/20 0.60
CA1 P00915 1/20 0.60
CA2 P00918 1/20 0.60
CA9 Q16790 1/20 0.60
MMP13 P45452 3/20 0.58
ADAMTS4 O75173 1/20 0.54
MMP14 P50281 1/20 0.54
ADAM17 P78536 1/20 0.54
ADAMTS5 Q9UNA0 1/20 0.54

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
SCHEMBL6824624 0.92 MMP2 (1.00) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL6823424 0.88 MMP1 (0.87) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL6823613 0.88 MMP2 (0.87) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL6820122 0.85 MMP1 (0.74) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL5703157 0.84 PDE4A (1.00) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7308283 0.82 MMP1 (0.80) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL6824204 0.81 PDE4A (1.00) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7073256 0.81 MMP2 (0.77) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7311479 0.81 PDE4A (0.77) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7299010 0.80 MMP1 (0.76) MMP2MMP1MMP3PDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6057369-A USE IN THE TREATMENT OF DISEASE STATES ASSOCIATED WITH PROTEINS THAT MEDIATE CELLULAR ACTIVITY WHICH ARE CAPABLE OF BEING MODULATED BY INHIBITING A MATRIX METALLOPROTEINASE (MMP), TUMOR NECROSIS FACTOR (TNF) OR CYCLIC AMP RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 2000-05-02 US claimed
EP-0871439-A4 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE POULENC RORER PHARMA (US) 1999-07-21 EP claimed
EP-0871439-A1 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS, INC. (US) 1998-10-21 EP claimed
WO-1997024117-A1 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 1997-07-10 WO claimed
EP-0871439-B1 SUBSTITUTED (ARYL, HETEROARYL, ARYLMETHYL OR HETEROARYLMETHYL) HYDROXAMIC ACID COMPOUNDS AVENTIS PHARMA INC (US) 2004-03-31 EP disclosed
US-6057369-A USE IN THE TREATMENT OF DISEASE STATES ASSOCIATED WITH PROTEINS THAT MEDIATE CELLULAR ACTIVITY WHICH ARE CAPABLE OF BEING MODULATED BY INHIBITING A MATRIX METALLOPROTEINASE (MMP), TUMOR NECROSIS FACTOR (TNF) OR CYCLIC AMP RHONE-POULENC RORER PHARMACEUTICALS INC. (US) 2000-05-02 US disclosed