SCHEMBL2367757

SCHEMBL2367757

CC(C)(C)OC(=O)NC[C@H](N)C(=O)OC(=O)OCc1ccccc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.60
IDO1 P14902 1/20 0.45
LTA4H P09960 1/20 0.43
CTSS P25774 3/20 0.43
PPARA Q07869 1/20 0.43
MAPT P10636 1/20 0.43
ATM Q13315 1/20 0.43
SLC1A3 P43003 1/20 0.42
SLC1A1 P43005 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
CTSL P07711 2/20 0.41
NTSR1 P30989 1/20 0.41
CTSB P07858 1/20 0.41
CTSK P43235 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CA12 O43570 1/20 0.41
CA1 P00915 1/20 0.41
CA7 P43166 1/20 0.41

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
SCHEMBL17878732 0.90 SYK (0.65) SYKIDO1LTA4HCTSSPPARA
SCHEMBL29879918 0.90 SYK (0.65) SYKIDO1LTA4HCTSSPPARA
SCHEMBL1021939 0.86 MAPT (0.52) SYKIDO1LTA4HMAPTSLC1A3
SCHEMBL918814 0.86 MAPT (0.52) SYKIDO1LTA4HMAPTSLC1A3
SCHEMBL7295558 0.85 MAPT (0.56) SYKIDO1MAPTSLC1A3SLC1A1
SCHEMBL3824366 0.85 MAPT (0.56) SYKIDO1MAPTSLC1A3SLC1A1
SCHEMBL6500075 0.85 SYK (0.61) SYKLTA4HCTSSMAPTSLC1A3
SCHEMBL7438565 0.81 SLC1A3 (0.41) SLC1A3SLC1A1SMN1; SMN2MEN1KMT2A
SCHEMBL1627707 0.80 SYK (0.67) SYKIDO1CTSSPPARAMAPT
SCHEMBL1627709 0.80 SYK (0.61) SYKIDO1LTA4HCTSSPPARA

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
EP-2007794-B1 LYSOBACTIN AMIDES AICURIS GMBH & CO KG (DE) 2011-09-14 EP disclosed