SCHEMBL7977828

SCHEMBL7977828

C=CCCCCN(C)C(=O)[C@H](Cc1ccc(OCc2ccccc2)cc1)NC(=O)[C@H](CCCC=C)CC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 10/20 0.44
MMP1 P03956 7/20 0.44
MMP3 P08254 7/20 0.44
MMP9 P14780 4/20 0.44
MMP8 P22894 2/20 0.44
MME P08473 1/20 0.43
ACE P12821 1/20 0.43
CPA1 P15085 1/20 0.43
ACE2 Q9BYF1 1/20 0.43
PPARG P37231 2/20 0.43
MAOB P27338 2/20 0.42

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
SCHEMBL7977831 1.00 MMP2 (0.44) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7989431 0.87 MMP9 (0.51) MMP9MMP8MMEACECPA1
SCHEMBL7989427 0.87 MMP9 (0.51) MMP9MMP8MMEACECPA1
SCHEMBL7987529 0.85 MMP3 (0.42) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7989516 0.85 MMP3 (0.42) MMP2MMP1MMP3MMP9MMP8
SCHEMBL7985989 0.83 FFAR1 (0.39) MAOB
SCHEMBL7975672 0.82 MMP2 (0.40) MMP2MMP1MMP3MMP8ACE
SCHEMBL7977132 0.82 MMP2 (0.40) MMP2MMP1MMP3MMP8ACE
SCHEMBL7986858 0.81 MMP2 (0.46) MMP2MMP1MMP3
SCHEMBL7975565 0.81 FOLH1 (0.47)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2001040198-A2 MACROCYCLIC HYDROXAMIC ACID DERIVATIVES AND THEIR USE AS ANTIMICROBIAL AGENTS AVENTIS PHARMA S.A. (FR) 2001-06-07 WO disclosed