SCHEMBL7434867

SCHEMBL7434867

Cc1ccc(Oc2ccc(S(=O)(=O)C(CNC(=O)O)[C@@H]3COC(C)(C)O3)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP9 P14780 5/20 0.43
MMP2 P08253 5/20 0.43
MMP13 P45452 4/20 0.43
MMP1 P03956 3/20 0.43
MMP8 P22894 2/20 0.43
MMP3 P08254 1/20 0.43
MMP7 P09237 1/20 0.43
GFER P55789 1/20 0.36
LMNA P02545 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MAPT P10636 1/20 0.35
FPR2 P25090 1/20 0.34
SCN9A Q15858 1/20 0.34
FFAR1 O14842 1/20 0.34
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
CYP2C9 P11712 2/20 0.34
CYP1A2 P05177 1/20 0.34

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
SCHEMBL7421796 0.93 MMP1 (0.43) MMP9MMP2MMP13MMP1MMP8
SCHEMBL7426328 0.89 MMP2 (0.40) MMP9MMP2MMP13MMP1MMP8
SCHEMBL7434872 0.80 MMP9 (0.52) MMP9MMP2MMP13MMP1MMP8
SCHEMBL7596473 0.78 MMP9 (0.51) MMP9MMP2MMP13MMP1MMP8
SCHEMBL9272490 0.73 ALDH1A1 (0.40) MMP9MMP2MMP13MMP1MMP8
SCHEMBL4429590 0.73 MMP9 (0.37) MMP9MMP2MMP13MMP1MMP8
SCHEMBL7421799 0.73 MMP9 (0.52) MMP9MMP2MMP13MMP1MMP8
SCHEMBL7425774 0.71 MMP9 (0.51) MMP9MMP2MMP13MMP1MMP8
SCHEMBL7595945 0.71 MMP9 (0.51) MMP9MMP2MMP13MMP1MMP8
SCHEMBL7596477 0.71 MMP9 (0.80) MMP9MMP2MMP13MMP1MMP8

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-1147101-A1 REVERSE HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 2001-10-24 EP claimed
WO-2000044739-A1 REVERSE HYDROXAMATE INHIBITORS OF MATRIX METALLOPROTEINASES ABBOTT LABORATORIES (US) 2000-08-03 WO claimed