SCHEMBL7692016

SCHEMBL7692016

CCOC(=O)CC(Cc1ccccc1)S(=O)(=O)c1ccc(OC)cc1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 11/20 0.69
MMP2 P08253 10/20 0.69
MMP3 P08254 9/20 0.69
PDE4A P27815 8/20 0.69
PDE4B Q07343 8/20 0.69
PDE4C Q08493 8/20 0.69
PDE4D Q08499 8/20 0.69
MMP13 P45452 4/20 0.61
MMP9 P14780 2/20 0.56
NPC1 O15118 2/20 0.47
ALDH1A1 P00352 2/20 0.47
RAB9A P51151 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
LMNA P02545 1/20 0.47
MAPT P10636 1/20 0.47
PPARG P37231 1/20 0.46
PPARA Q07869 1/20 0.46
TDP1 Q9NUW8 1/20 0.46

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
SCHEMBL7073256 0.86 MMP2 (0.77) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL6824624 0.82 MMP2 (1.00) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL6934585 0.81 MMP1 (0.70) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL12268068 0.79 MMP8 (0.47) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL7207040 0.79 MMP1 (0.76) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL12268065 0.78 MMP8 (0.46) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL7305191 0.78 MMP1 (0.76) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL6932995 0.77 MMP1 (0.54) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL7212123 0.76 MMP1 (1.00) MMP1MMP2MMP3PDE4APDE4B
SCHEMBL6823613 0.76 MMP2 (0.87) MMP1MMP2MMP3PDE4APDE4B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6342508-B1 ENZYME INHIBITORS FOR PROTECTION OF CONNECTIVE TISSUES AMERICAN CYANAMID COMPANY 2002-01-29 US disclosed