SCHEMBL16615920

SCHEMBL16615920

CC(O)[C@@H]1NC(=O)[C@@H](N)CCC(=O)NCCCC[C@@H](C(=O)N[C@@H](CO)C(N)=O)NC[C@H](CO)NC1=O

nearest known ligand 0.38

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MMP1 P03956 5/20 0.38
MMP9 P14780 5/20 0.38
ADAM17 P78536 3/20 0.38
POLB P06746 2/20 0.36
L3MBTL1 Q9Y468 2/20 0.36
TDP1 Q9NUW8 1/20 0.36
SRC P12931 1/20 0.35
SIRT2 Q8IXJ6 6/20 0.34
SIRT1 Q96EB6 6/20 0.34
SIRT3 Q9NTG7 6/20 0.34
BRAF P15056 1/20 0.34
MLLT3 P42568 1/20 0.34
MLLT1 Q03111 1/20 0.34
KLK7 P49862 1/20 0.33
MMP3 P08254 4/20 0.33
MMP2 P08253 3/20 0.33
MMP8 P22894 3/20 0.33

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
SCHEMBL16615893 0.91 MMP1 (0.39) MMP1MMP9ADAM17POLBL3MBTL1
SCHEMBL16615897 0.87 MMP1 (0.37) MMP1MMP9ADAM17POLBL3MBTL1
SCHEMBL16615761 0.82 MMP1 (0.41) MMP1MMP9ADAM17POLBL3MBTL1
SCHEMBL16615902 0.81 MMP1 (0.42) MMP1MMP9ADAM17POLBL3MBTL1
SCHEMBL16615755 0.79 STAT3 (0.43) SRCMLLT3MLLT1
SCHEMBL16615752 0.78 SRC (0.40) SRCMLLT3MLLT1
SCHEMBL16615895 0.78 MMP1 (0.40) MMP1MMP9ADAM17POLBL3MBTL1
SCHEMBL16615894 0.78 POLB (0.46) MMP1MMP9ADAM17POLBL3MBTL1
SCHEMBL16615853 0.76 MLLT3 (0.35) MMP1MMP9SRCMLLT3MLLT1
SCHEMBL16691469 0.75 SRC (0.49) MMP1MMP9POLBL3MBTL1TDP1

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-2015044900-A1 THERAPEUTIC IMMUNOMODULATING COMPOUNDS AURIGENE DISCOVERY TECHNOLOGIES LIMITED (IN) 2015-04-02 WO disclosed