SCHEMBL6963708

SCHEMBL6963708

Cc1cc(C2=CCN(S(=O)(=O)C3(C(=O)O)CCOC(C)C3)CC2)ccc1Br

nearest known ligand 0.42

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 15/20 0.42
MMP3 P08254 13/20 0.42
L3MBTL1 Q9Y468 1/20 0.37
MMP14 P50281 1/20 0.37
ADAMTS5 Q9UNA0 1/20 0.37
ADAM10 O14672 3/20 0.33
MMP1 P03956 1/20 0.33
MMP9 P14780 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 0.33
PTGDR Q13258 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
SCHEMBL6965353 0.87 MMP2 (0.46) MMP2MMP3L3MBTL1MMP14ADAMTS5
SCHEMBL6433272 0.80 MMP2 (0.44) MMP2MMP3L3MBTL1MMP14ADAM10
SCHEMBL7452465 0.78 ABL1 (0.33) LMNA
SCHEMBL6583989 0.75 MMP2 (0.60) MMP2MMP3L3MBTL1MMP14ADAMTS5
SCHEMBL6963483 0.72
SCHEMBL6586078 0.72 MMP2 (0.64) MMP2MMP3L3MBTL1MMP14ADAMTS5
SCHEMBL6437476 0.72 MMP2 (0.49) MMP2MMP3L3MBTL1LMNATHRB
SCHEMBL6585837 0.71 MMP2 (0.50) MMP2MMP3L3MBTL1LMNATHRB
SCHEMBL6584500 0.71 MMP2 (0.53) MMP2MMP3L3MBTL1MMP14ADAMTS5
SCHEMBL6440525 0.70 MMP2 (0.59) MMP2MMP3L3MBTL1LMNATHRB

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