SCHEMBL7986858

SCHEMBL7986858

C=CCCC[C@H](CC(=O)O)C(=O)N[C@@H](CCc1ccccc1)C(=O)N(C)CCCC=C

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
MMP2 P08253 20/20 0.46
MMP3 P08254 8/20 0.46
MMP1 P03956 4/20 0.45

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
SCHEMBL7993920 0.85 ALDH1A1 (0.39)
SCHEMBL7993921 0.85 ALDH1A1 (0.39)
SCHEMBL7989516 0.84 MMP3 (0.42) MMP2MMP3MMP1
SCHEMBL7987529 0.84 MMP3 (0.42) MMP2MMP3MMP1
SCHEMBL7990047 0.83 PDF (0.50) MMP2MMP3MMP1
SCHEMBL7986859 0.83 MMP9 (0.45) MMP2MMP3MMP1
SCHEMBL7986628 0.82 MMP2 (0.42) MMP2MMP3MMP1
SCHEMBL7987314 0.81 MME (0.41) MMP2MMP3MMP1
SCHEMBL7975565 0.81 FOLH1 (0.47)
SCHEMBL7975562 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