SCHEMBL14701569

SCHEMBL14701569

CC(C)CC(C)(C)C(=O)O[C@@H](C(=O)O)[C@@H](OC(=O)C(C)(C)CC(C)(C)C)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 1/20 0.36
MMP2 P08253 1/20 0.36
MMP3 P08254 1/20 0.36
MMP9 P14780 1/20 0.36
MMP13 P45452 1/20 0.36
MMP8 P22894 1/20 0.32

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
SCHEMBL14701568 1.00 MMP1 (0.36) MMP1MMP2MMP3MMP9MMP13
SCHEMBL19852089 0.89 SLC1A3 (0.34) MMP1MMP2MMP3MMP9MMP13
SCHEMBL14701571 0.89 SLC1A3 (0.34) MMP1MMP2MMP3MMP9MMP13
SCHEMBL19851970 0.89 SLC1A3 (0.34) MMP1MMP2MMP3MMP9MMP13
SCHEMBL19328626 0.80 MMP8 (0.36) MMP8
SCHEMBL14701647 0.77 MMP2 (0.33) MMP2MMP9MMP8
SCHEMBL12120675 0.77
SCHEMBL19851978 0.76
SCHEMBL24140629 0.74 MMP8 (0.36) MMP8
SCHEMBL12120664 0.74 TSHR (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-2013023003-A1 BIOACTIVE AMPHIPHILIC POLYMER STABILIZED NANOPARTICLES WITH ENHANCED STABILITY AND ACTIVITY RUTGERS, THE STATE UNIVERSITY OF NEW JERSEY (US) 2013-02-14 WO disclosed