SCHEMBL7313243

SCHEMBL7313243

O=C(O)CC(Cc1ccccc1)S(=O)(=O)c1ccc(Sc2ccccc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 7/20 0.51
MMP1 P03956 5/20 0.51
MMP3 P08254 3/20 0.51
PDE4A P27815 2/20 0.51
PDE4B Q07343 2/20 0.51
PDE4C Q08493 2/20 0.51
PDE4D Q08499 2/20 0.51
MMP13 P45452 9/20 0.43
CPA1 P15085 2/20 0.43
CPB1 P15086 1/20 0.43
CPA3 P15088 1/20 0.43
CPB2 Q96IY4 1/20 0.43
SLC6A4 P31645 1/20 0.41
MMP8 P22894 1/20 0.40
MMP9 P14780 4/20 0.39
ADAMTS4 O75173 1/20 0.38

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
SCHEMBL7306315 0.87 MMP1 (0.69) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7301198 0.83 MMP2 (0.56) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7311140 0.81 MMP1 (0.54) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7311143 0.81 MMP1 (0.54) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7308096 0.80 MMP1 (0.57) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7073256 0.80 MMP2 (0.77) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL27477106 0.76 PPARG (0.52) MMP2MMP1MMP3PDE4APDE4B
SCHEMBL7302912 0.74 CPA1 (0.51) CPA1CPB1CPA3CPB2SLC6A4
SCHEMBL11828088 0.73 SLC6A4 (0.51) MMP2MMP13CPA1CPB1CPA3
SCHEMBL7299010 0.72 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0780386-B1 Matrix metalloprotease inhibitors HOFFMANN LA ROCHE (CH) 2002-10-02 EP disclosed
US-5932595-A ANTIARTHRITIC AGENT; MULTIPLE SCLEROSIS; OSTEOPOROSIS; RESPIRATORY SYSTEM DISORDERS; SKIN DISORDERS; ANTIULCER AGENT SYNTEX (U.S.A.) INC. (US) 1999-08-03 US disclosed
EP-0780386-A1 Matrix metalloprotease inhibitors F. HOFFMANN-LA ROCHE AG (CH) 1997-06-25 EP disclosed