SCHEMBL9716619

SCHEMBL9716619

NCCCC[C@@H](C(=O)O)N(C(=O)c1ccc(O)cc1)C(=O)c1ccc(O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 1/20 0.40
LNPEP Q9UIQ6 2/20 0.40
ERAP2 Q6P179 1/20 0.40
GSR P00390 1/20 0.39
SLC7A5 Q01650 1/20 0.38
RNPEP Q9H4A4 1/20 0.38
ADRA2C P18825 1/20 0.37
HPGDS O60760 1/20 0.36
EPOR P19235 2/20 0.36
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA3 P07451 1/20 0.35
TYR P14679 1/20 0.35
DRD1 P21728 1/20 0.35
CA4 P22748 1/20 0.35
CA6 P23280 1/20 0.35
CA5A P35218 1/20 0.35
CA7 P43166 1/20 0.35
CA9 Q16790 1/20 0.35

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
SCHEMBL9716611 1.00 F2 (0.40) F2LNPEPERAP2GSRSLC7A5
SCHEMBL9716674 0.95 SLC7A5 (0.39) F2LNPEPERAP2SLC7A5ADRA2C
SCHEMBL9716685 0.95 SLC7A5 (0.39) F2LNPEPERAP2SLC7A5ADRA2C
SCHEMBL9716819 0.88 F2 (0.40) F2LNPEPERAP2GSRRNPEP
SCHEMBL9716829 0.88 F2 (0.40) F2LNPEPERAP2GSRRNPEP
SCHEMBL9716623 0.88 F2 (0.50) F2GSRRNPEPADRA2CEPOR
SCHEMBL1387992 0.88 F2 (0.50) F2GSRRNPEPADRA2CEPOR
SCHEMBL7321837 0.88 F2 (0.50) F2GSRRNPEPADRA2CEPOR
SCHEMBL9716660 0.87 F2 (0.42) F2LNPEPERAP2GSRRNPEP
SCHEMBL18063663 0.85 GSR (0.39) F2LNPEPERAP2GSRRNPEP

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