SCHEMBL6972911

SCHEMBL6972911

Cc1cc(C2CCN(S(=O)(=O)C(C)(CO)CNC(=O)c3ccccc3O)CC2)ccc1-c1nccs1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.42
MMP3 P08254 7/20 0.42
MMP1 P03956 2/20 0.42
MMP9 P14780 2/20 0.42
MMP14 P50281 2/20 0.42
USP5 P45974 2/20 0.36
KDM6B O15054 1/20 0.34
DRD4 P21917 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
KIF18A Q8NI77 1/20 0.34
FAAH O00519 1/20 0.33
EPHX2 P34913 1/20 0.33
HCRTR2 O43614 2/20 0.32
MEN1 O00255 1/20 0.32
LMNA P02545 1/20 0.32
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
KMT2A Q03164 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
S1PR1 P21453 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
SCHEMBL6587292 0.82 MMP2 (0.58) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6586529 0.81 MMP2 (0.65) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6590134 0.81 MMP2 (0.66) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6965292 0.81 MMP2 (0.67) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6972711 0.81 MMP2 (0.60) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6588282 0.80 MMP2 (0.67) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6434601 0.77 MMP2 (0.48) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6971890 0.76 MMP2 (0.61) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6437356 0.76 MMP2 (0.50) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6437057 0.76 MMP2 (0.47) 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-1181017-B1 METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-04-16 EP claimed