SCHEMBL7758488

SCHEMBL7758488

COC(=O)c1ccc(NC(=O)C(NC(=O)C(CCc2ccccc2)CC(=O)O)C(C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 11/20 0.56
MMP3 P08254 7/20 0.56
MMP1 P03956 1/20 0.50
MMP9 P14780 1/20 0.50
MMP14 P50281 1/20 0.50
LMNA P02545 1/20 0.50
MAPT P10636 1/20 0.50
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HTT P42858 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47

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
SCHEMBL7763178 0.88 MMP2 (0.74) MMP2MMP3
SCHEMBL7762285 0.83 MMP2 (0.82) MMP2MMP3
SCHEMBL7758470 0.79 MMP2 (0.75) MMP2MMP3MMP1MMP9MMP14
SCHEMBL9289897 0.76 MMP3 (0.58) MMP2MMP3MMP1
SCHEMBL7762157 0.76 MMP2 (0.58) MMP2MMP3MMP1
SCHEMBL7761449 0.75 MMP2 (0.83) MMP2MMP3MMP1MMP9MMP14
SCHEMBL29134528 0.74 RAB9A (0.64) LMNAMAPTNPC1RAB9AHTT
SCHEMBL29134529 0.74 RAB9A (0.64) LMNAMAPTNPC1RAB9AHTT
SCHEMBL24932670 0.74 MMP2 (0.55) MMP2MMP3
SCHEMBL7758535 0.73 MMP3 (0.59) MMP2MMP3MMP1MMP9

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