SCHEMBL7538112

SCHEMBL7538112

Cc1cc(C2CCN(S(=O)(=O)C(C)(C)C(=O)O)CC2)ccc1-c1cccc(OC[C@H](O)CO)c1

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 8/20 0.68
MMP3 P08254 8/20 0.68
MMP1 P03956 2/20 0.68
MMP9 P14780 2/20 0.68
MMP14 P50281 2/20 0.68
PRMT5 O14744 3/20 0.40
WDR77 Q9BQA1 3/20 0.40
TSHR P16473 1/20 0.36
MAPK1 P28482 1/20 0.36
BCL9 O00512 1/20 0.36
CTNNB1 P35222 1/20 0.36
PTGDR Q13258 1/20 0.35
CSF1R P07333 2/20 0.35

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
SCHEMBL6436523 1.00 MMP2 (0.68) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6433752 0.94 MMP2 (0.66) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7432313 0.94 MMP2 (0.66) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6971949 0.93 MMP2 (0.68) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6971954 0.93 MMP2 (0.68) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6956464 0.92 MMP3 (0.81) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7408826 0.89 MMP2 (0.82) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6587437 0.87 MMP2 (0.83) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6590361 0.85 MMP3 (0.60) MMP2MMP3MMP1MMP9MMP14
SCHEMBL6437467 0.82 MMP2 (0.51) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1181017-A1 METALLOPROTEASE INHIBITORS Pfizer Limited (GB) 2002-02-27 EP disclosed
WO-2000074681-A1 METALLOPROTEASE INHIBITORS PFIZER LIMITED (GB) 2000-12-14 WO disclosed