SCHEMBL6973195

SCHEMBL6973195

CCOC(COc1cccc(-c2ccc(C3CCN(S(=O)(=O)C4(C(=O)O)CCOCC4)CC3)cc2C)c1)OCC

nearest known ligand 0.53

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 12/20 0.53
MMP3 P08254 9/20 0.53
MMP9 P14780 3/20 0.49
MMP1 P03956 2/20 0.49
MMP14 P50281 2/20 0.49
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
EPHX1 P07099 1/20 0.33
MMP13 P45452 3/20 0.33
ALDH1A1 P00352 2/20 0.33
DHODH Q02127 1/20 0.33
MEN1 O00255 1/20 0.32
NPC1 O15118 1/20 0.32
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
RAB9A P51151 1/20 0.32
KMT2A Q03164 1/20 0.32
FFAR1 O14842 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
SCHEMBL6434175 0.93 MMP2 (0.54) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6959536 0.92 MMP2 (0.51) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6433679 0.90 MMP2 (0.51) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6433156 0.90 MMP2 (0.51) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6437467 0.90 MMP2 (0.51) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6971910 0.87 MMP2 (0.63) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6959909 0.87 MMP2 (0.51) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6586243 0.87 MMP2 (0.49) MMP2MMP3MMP9MMP1MMP14
SCHEMBL6587889 0.84 MMP2 (0.65) MMP2MMP3MMP9MMP1MMP14
SCHEMBL7415783 0.84 MMP2 (0.65) MMP2MMP3MMP9MMP1MMP14

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1181017-B1 METALLOPROTEASE INHIBITORS PFIZER LTD (GB) 2003-04-16 EP claimed
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