SCHEMBL7758535

SCHEMBL7758535

COC(=O)c1ccc(NC(=O)C(CC(C)C)NC(=O)C(CCCc2ccc(CCCO)cc2)CC(=O)O)cc1

nearest known ligand 0.59

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MMP3 P08254 14/20 0.59
MMP1 P03956 2/20 0.59
MMP7 P09237 1/20 0.59
MMP2 P08253 12/20 0.51
CYP4A11 Q02928 2/20 0.49
CYP4F2 P78329 1/20 0.46
MMP9 P14780 1/20 0.43

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
SCHEMBL7764977 0.96 MMP3 (0.59) MMP3MMP1MMP7MMP2CYP4A11
SCHEMBL9289897 0.92 MMP3 (0.58) MMP3MMP1MMP7MMP2
SCHEMBL7763165 0.90 MMP3 (0.56) MMP3MMP1MMP7MMP2MMP9
SCHEMBL7763668 0.89 MMP3 (0.54) MMP3MMP1MMP7MMP2
SCHEMBL7763176 0.87 MMP3 (0.53) MMP3MMP1MMP7MMP2MMP9
SCHEMBL7763812 0.87 MMP3 (0.54) MMP3MMP1MMP7MMP2MMP9
SCHEMBL7762202 0.87 MMP3 (0.52) MMP3MMP1MMP7MMP2MMP9
SCHEMBL7762087 0.87 MMP3 (0.52) MMP3MMP1MMP7MMP2
SCHEMBL7763782 0.85 MMP3 (0.51) MMP3MMP1MMP7MMP2MMP9
SCHEMBL7763701 0.85 MMP3 (0.50) MMP3MMP1MMP7MMP2MMP9

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