SCHEMBL8364872

SCHEMBL8364872

CNc1cccc(S(=O)(=O)N2CCC(Oc3ccc(C(F)(F)F)cc3)CC2)c1C(=O)NO

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP13 P45452 7/20 0.78
MMP2 P08253 6/20 0.78
FPR2 P25090 1/20 0.48
PROKR1 Q8TCW9 1/20 0.48
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
MMP12 P39900 1/20 0.44
TP53 P04637 1/20 0.43
USP5 P45974 1/20 0.42
MAPT P10636 2/20 0.42
LIPE Q05469 1/20 0.42
EPHX2 P34913 1/20 0.42
SCN9A Q15858 2/20 0.41
KCNH2 Q12809 1/20 0.41
SCN5A Q14524 1/20 0.41
GAA P10253 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
MAPK1 P28482 1/20 0.41

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
SCHEMBL8364812 0.91 MMP13 (0.76) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL5898973 0.88 MMP13 (1.00) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL5898969 0.88 MMP13 (0.82) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL8364987 0.87 MMP13 (0.78) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL8361681 0.85 MMP13 (0.78) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL8363040 0.85 MMP13 (0.75) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL5898962 0.84 MMP13 (0.72) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL8364898 0.84 MMP13 (0.72) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL8363743 0.83 MMP13 (0.71) MMP13MMP2FPR2PROKR1MEN1
SCHEMBL5898960 0.83 MMP13 (1.00) MMP13MMP2FPR2PROKR1MEN1

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
WO-2003007954-A2 SULFONYL ARYL HYDROXAMATES AND THEIR USE AS MATRIX METALLOPROTEASE INHIBITORS PHARMACIA CORPORATION (US) 2003-01-30 WO disclosed