SCHEMBL7975565

SCHEMBL7975565

C=CCCCCN(C)C(=O)[C@H](CCCCNC(=O)OCc1ccccc1)NC(=O)C(CCCC=C)CC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 5/20 0.47
TGM2 P21980 4/20 0.43
PTGER4 P35408 1/20 0.43
SIRT2 Q8IXJ6 2/20 0.43
CPB1 P15086 1/20 0.43
CPB2 Q96IY4 1/20 0.43
SIRT1 Q96EB6 1/20 0.42
SIRT3 Q9NTG7 1/20 0.42
SIRT5 Q9NXA8 1/20 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
SCHEMBL7975562 1.00 FOLH1 (0.47) FOLH1TGM2PTGER4SIRT2CPB1
SCHEMBL7989516 0.84 MMP3 (0.42) FOLH1
SCHEMBL7986858 0.81 MMP2 (0.46)
SCHEMBL7977831 0.81 MMP2 (0.44)
SCHEMBL7977828 0.81 MMP2 (0.44)
SCHEMBL7987530 0.77 MMP3 (0.37)
SCHEMBL24130652 0.75 FOLH1 (0.60) FOLH1SIRT2SIRT1SIRT3SIRT5
SCHEMBL24130242 0.75 FOLH1 (0.60) FOLH1SIRT2SIRT1SIRT3SIRT5
SCHEMBL7990047 0.75 PDF (0.50)
SCHEMBL7985989 0.74 FFAR1 (0.39)

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