SCHEMBL7763149

SCHEMBL7763149

CC(C)CC(CC(=O)NO)C(=O)N[C@H](C(=O)O)C(C)(C)C.COC(=O)c1ccc(NC=O)cc1

nearest known ligand 0.61

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 13/20 0.61
MMP3 P08254 12/20 0.61
MMP7 P09237 7/20 0.61
MMP2 P08253 13/20 0.54
MMP9 P14780 9/20 0.54
MMP8 P22894 6/20 0.54
MMP13 P45452 4/20 0.54
MMP14 P50281 3/20 0.54
ADAM17 P78536 1/20 0.54
MMP12 P39900 2/20 0.45
FCER2 P06734 2/20 0.44

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
SCHEMBL7451414 0.89 MMP1 (0.71) MMP1MMP3MMP7MMP2MMP9
SCHEMBL7374287 0.79 MMP1 (0.58) MMP1MMP3MMP7MMP2MMP9
SCHEMBL7763578 0.79 MMP1 (0.58) MMP1MMP3MMP7MMP2MMP9
SCHEMBL7762136 0.76 MMP1 (1.00) MMP1MMP3MMP7MMP2MMP9
SCHEMBL7758581 0.76 MMP3 (0.61) MMP1MMP3MMP7MMP2MMP9
SCHEMBL6418504 0.74 MMP1 (0.44) MMP1MMP3MMP7MMP2MMP9
SCHEMBL7050036 0.74 MMP1 (0.44) MMP1MMP3MMP7MMP2MMP9
SCHEMBL7761307 0.73 MMP1 (0.46) MMP1MMP3MMP7MMP2MMP9
Ro-319790 SCHEMBL31060724 0.72 MMP1 (1.00) MMP1MMP3MMP7MMP2MMP9
Ro-319790 SCHEMBL5494052 0.72 MMP1 (1.00) MMP1MMP3MMP7MMP2MMP9

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-1098662-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2001-05-16 EP disclosed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO disclosed