SCHEMBL7758470

SCHEMBL7758470

COC(=O)c1ccc(NC(=O)C(NC(=O)C(CCc2ccccc2)CC(=O)NO)C(C)(C)C)cc1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 20/20 0.75
MMP3 P08254 10/20 0.75
MMP1 P03956 1/20 0.66
MMP9 P14780 1/20 0.66
MMP14 P50281 1/20 0.66

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
SCHEMBL7761449 0.95 MMP2 (0.83) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7763178 0.91 MMP2 (0.74) MMP2MMP3
SCHEMBL7762285 0.86 MMP2 (0.82) MMP2MMP3
SCHEMBL7763773 0.86 MMP3 (0.62) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7758488 0.79 MMP2 (0.56) MMP2MMP3MMP1MMP9MMP14
Methyl Benzoate SCHEMBL7763173 0.78 MMP2 (0.48) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7762295 0.76 MMP2 (0.62) MMP2MMP3
SCHEMBL8664107 0.75 MMP2 (0.80) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7758581 0.74 MMP3 (0.61) MMP2MMP3MMP1MMP9MMP14
SCHEMBL7051257 0.74 MMP2 (0.49) 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 4 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 claimed
WO-2000004892-A2 COADMINISTRATION OF ACAT AND MMP INHIBITORS FOR THE TREATMENT OF ATHEROSCLEROTIC LESIONS WARNER-LAMBERT COMPANY (US) 2000-02-03 WO claimed
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