SCHEMBL9716773

SCHEMBL9716773

CCCC(=O)N(C(=O)CCC)[C@@H](CCCN)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CPB2 Q96IY4 5/20 0.38
GSR P00390 1/20 0.36
CYP1A2 P05177 2/20 0.35
RNPEP Q9H4A4 1/20 0.35
SLC1A2 P43004 3/20 0.35
SLC1A1 P43005 3/20 0.35
SLC1A3 P43003 2/20 0.35
GABRR1 P24046 3/20 0.34
GRIK1 P39086 3/20 0.34
GRIK2 Q13002 3/20 0.34
DDAH1 O94760 1/20 0.34
NOS1 P29475 1/20 0.34
SLC6A5 Q9Y345 1/20 0.33
GABRR3 A8MPY1 1/20 0.33
GABRP O00591 1/20 0.33
GABRD O14764 1/20 0.33
HDAC3 O15379 1/20 0.33
GABBR2 O75899 1/20 0.33
LMNA P02545 1/20 0.33
THRB P10828 1/20 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
SCHEMBL9716770 1.00 CPB2 (0.38) CPB2GSRCYP1A2RNPEPSLC1A2
SCHEMBL1886100 0.95 GSR (0.43) CPB2GSRRNPEPSLC1A2SLC1A1
SCHEMBL1886103 0.95 GSR (0.43) CPB2GSRRNPEPSLC1A2SLC1A1
SCHEMBL32679720 0.93 GSR (0.42) CPB2GSRRNPEPSLC1A2SLC1A1
SCHEMBL32679719 0.93 GSR (0.42) CPB2GSRRNPEPSLC1A2SLC1A1
SCHEMBL32679718 0.93 GSR (0.42) CPB2GSRRNPEPSLC1A2SLC1A1
SCHEMBL7192319 0.90 FFAR4 (0.41) SLC1A2SLC1A1GRIK1GRIK2SLC6A5
SCHEMBL7192321 0.90 FFAR4 (0.41) SLC1A2SLC1A1GRIK1GRIK2SLC6A5
SCHEMBL9716621 0.89 FFAR4 (0.44) GRIK1GRIK2SLC6A5TSHRKMT2A
SCHEMBL9716640 0.89 FFAR4 (0.44) GRIK1GRIK2SLC6A5TSHRKMT2A

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-0178911-B1 COMPOSITION CONTAINING A PENEM OR CARBAPENEM ANTIBIOTIC SANKYO COMPANY LIMITED (JP) 1992-01-22 EP disclosed
EP-0178911-A2 Composition containing a penem or carbapenem antibiotic SANKYO COMPANY LIMITED (JP) 1986-04-23 EP disclosed