SCHEMBL7595064

SCHEMBL7595064

O=C(O)Cc1ccccc1OS(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CXCL8 P10145 2/20 0.47
CHRM1 P11229 1/20 0.39
AKR1B1 P15121 1/20 0.39
MMP2 P08253 7/20 0.39
MMP13 P45452 6/20 0.39
MMP1 P03956 5/20 0.39
MMP9 P14780 5/20 0.39
MMP12 P39900 4/20 0.39
MMP14 P50281 4/20 0.39
MMP3 P08254 3/20 0.39
CFD P00746 1/20 0.38
PLG P00747 1/20 0.38
PLAU P00749 1/20 0.38
F11 P03951 1/20 0.38
KLKB1 P03952 1/20 0.38
F7 P08709 1/20 0.38
TPSB2 P20231 1/20 0.38
CA1 P00915 4/20 0.38
CA2 P00918 4/20 0.38
MMP8 P22894 4/20 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
SCHEMBL2895999 0.75 CA2 (0.41) MMP2MMP13MMP1MMP9CA1
SCHEMBL6479936 0.74 CA2 (0.45) MMP2MMP13MMP1MMP9CA1
SCHEMBL31299569 0.74 CA1 (0.38) MMP2MMP13MMP1MMP9CA1
SCHEMBL9562242 0.74 CA1 (0.38) MMP2MMP13MMP1MMP9CA1
SCHEMBL6474903 0.73 PIK3CD (0.39) CA1CA2L3MBTL1
SCHEMBL3696269 0.73 CA2 (0.42) MMP2MMP13MMP1MMP9CA1
SCHEMBL11103498 0.73 CXCL8 (0.53) CXCL8CHRM1AKR1B1MMP2MMP13
SCHEMBL6900759 0.73 CA2 (0.46) MMP2MMP13MMP1MMP9CA1
Iodide SCHEMBL5315919 0.73 PIK3CD (0.44) MMP2MMP13MMP1MMP9CA1
SCHEMBL27366575 0.73 PIK3CD (0.44) MMP2MMP13MMP1MMP9CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1255726-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8 INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.P.A. (IT) 2002-11-13 EP disclosed
WO-2001058852-A2 (R)-2-ARYL-PROPIONAMIDES, USEFUL IN THE INHIBITION OF IL-8-INDUCED CHEMIOTAXIS OF NEUTROPHILS Dompé S.p.A. (IT) 2001-08-16 WO disclosed