SCHEMBL6590134

SCHEMBL6590134

Cc1cc(C2CCN(S(=O)(=O)C(C)(CO)CNC(=O)c3ccccc3O)CC2)ccc1-c1cccc(OCCO)c1

nearest known ligand 0.66

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.66
MMP3 P08254 10/20 0.66
MMP1 P03956 2/20 0.66
MMP9 P14780 2/20 0.66
MMP14 P50281 2/20 0.66
HTR7 P34969 2/20 0.39
KMT2A Q03164 2/20 0.34
MEN1 O00255 1/20 0.34
POLB P06746 1/20 0.34
USP5 P45974 2/20 0.33
MAOB P27338 2/20 0.33
MAOA P21397 1/20 0.33
NPC1 O15118 1/20 0.32
TP53 P04637 1/20 0.32
MAPT P10636 1/20 0.32
RAB9A P51151 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL6588282 0.96 MMP2 (0.67) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6586529 0.94 MMP2 (0.65) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6965292 0.87 MMP2 (0.67) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6586414 0.87 MMP2 (0.54) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6972711 0.82 MMP2 (0.60) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6587292 0.82 MMP2 (0.58) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6972911 0.81 MMP2 (0.42) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6585851 0.80 MMP3 (1.00) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6586686 0.78 MMP2 (0.60) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6586333 0.77 MMP2 (0.85) MMP2MMP3MMP1MMP9MMP14

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
EP-1036062-B1 HYDROXAMIC ACID DERIVATIVES AS MATRIX METALLOPROTEASE (MMP) INHIBITORS PFIZER LTD (GB) 2004-01-02 EP claimed