Zinc Ion

Zinc Ion

SCHEMBL8974979

NC(=O)NCC(O)CO.[O-2].[Zn+2]

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
BCAT2 O15382 1/20 0.41
LMNA P02545 2/20 0.35
ALDH1A1 P00352 2/20 0.35
EGFR P00533 1/20 0.34
SRC P12931 1/20 0.34
CA2 P00918 1/20 0.34
CYP2C19 P33261 1/20 0.33
HIF1A Q16665 1/20 0.33
DRD3 P35462 1/20 0.33
SLC6A3 Q01959 1/20 0.33
KDM4E B2RXH2 1/20 0.33
HPGD P15428 1/20 0.33
TDP1 Q9NUW8 1/20 0.32
SLC6A2 P23975 1/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
CNR2 P34972 1/20 0.30

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
SCHEMBL1315186 0.95
SCHEMBL10056070 0.95
SCHEMBL10055927 0.95
SCHEMBL12461756 0.83 BCAT2 (0.48) BCAT2LMNAALDH1A1CA2CYP2C19
SCHEMBL28172876 0.78 LMNA (0.35) BCAT2LMNAALDH1A1EGFRSRC
SCHEMBL4572748 0.77 BCAT2 (0.41) BCAT2ALDH1A1TDP1MEN1KMT2A
SCHEMBL30171822 0.76
SCHEMBL8663853 0.76 LMNA (0.33) LMNAALDH1A1EGFRSRCCA2
SCHEMBL25262351 0.75 LMNA (0.42) LMNAALDH1A1EGFRSRCCA2
SCHEMBL25763048 0.75 ALDH1A1 (0.42) LMNAALDH1A1EGFRSRCCA2

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0625519-B1 Method for the production of alkylene carbonates MITSUBISHI GAS CHEMICAL CO (JP) 1996-04-10 EP disclosed
US-5440004-A Method and apparatus for the production of alkylene carbonate MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1995-08-08 US disclosed
EP-0625519-A1 Method for the production of alkylene carbonates MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 1994-11-23 EP disclosed