SCHEMBL7360512

SCHEMBL7360512

CCCCCCCC(CN1CCCCC1)N(O)C(=O)C(CC(C)C)C(N)=O

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.35
ALDH1A1 P00352 1/20 0.35
BCHE P06276 5/20 0.34
GAA P10253 1/20 0.32
MMP1 P03956 1/20 0.31
MMP3 P08254 1/20 0.31
MMP9 P14780 1/20 0.31
MMP8 P22894 1/20 0.31
UGCG Q16739 2/20 0.31
KDM4E B2RXH2 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL7349299 0.83 MMP8 (0.38) MMP3MMP8
SCHEMBL7356874 0.82 UGCG (0.40) MMP1UGCG
SCHEMBL7352363 0.78 UGCG (0.46) ALDH1A1UGCGMEN1KMT2A
SCHEMBL7348722 0.69 MMP8 (0.40) MMP8
SCHEMBL7360505 0.67 MMP8 (0.50) L3MBTL1ALDH1A1MMP1MMP3MMP9
SCHEMBL8498698 0.66 L3MBTL1 (0.47) L3MBTL1BCHEMEN1KMT2ATDP1
SCHEMBL20755330 0.65 LMNA (0.35) L3MBTL1ALDH1A1GAAUGCGMEN1
SCHEMBL7353864 0.64 CSNK1E (0.48) MMP1MMP3
Cyclohexane SCHEMBL19244609 0.63 GPR84 (0.59)
SCHEMBL22236670 0.63 LMNA (0.43) L3MBTL1ALDH1A1BCHEGAAUGCG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1009736-A1 MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS Roche Diagnostics GmbH (DE) 2000-06-21 EP disclosed
WO-1999011608-A1 MALONIC ACID BASED MATRIX METALLOPROTEINASE INHIBITORS ROCHE DIAGNOSTICS GMBH (DE) 1999-03-11 WO disclosed