SCHEMBL8604228

SCHEMBL8604228

C[C@H](NNC(=O)C(=O)O)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.35
KDM5B Q9UGL1 1/20 0.35
SLC7A5 Q01650 1/20 0.35
RAB9A P51151 1/20 0.31
MME P08473 1/20 0.31
ACE P12821 1/20 0.31
CPA1 P15085 1/20 0.31
ACE2 Q9BYF1 1/20 0.31

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
SCHEMBL12481867 0.79 TGFBR1 (0.42) TP53SLC7A5
SCHEMBL2555426 0.79 TGFBR1 (0.42) TP53SLC7A5
SCHEMBL542299 0.77 ALDH1A1 (0.37) TP53SLC7A5RAB9AMMEACE
SCHEMBL542297 0.77 ALDH1A1 (0.37) TP53SLC7A5RAB9AMMEACE
SCHEMBL3416543 0.75 SLC7A5 (0.40) TP53SLC7A5RAB9AMMEACE
SCHEMBL3416544 0.75 SLC7A5 (0.40) TP53SLC7A5RAB9AMMEACE
SCHEMBL10408938 0.75 SLC7A5 (0.40) TP53SLC7A5RAB9AMMEACE
SCHEMBL43483 0.74 MME (0.42) TP53KDM5BRAB9AMMEACE
SCHEMBL6546062 0.74 MME (0.42) TP53KDM5BRAB9AMMEACE
SCHEMBL814779 0.74 MME (0.42) TP53KDM5BRAB9AMMEACE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108822469-A A kind of environmental-friendly halogen-free low-smoke high fire-retardance protective cover material 江苏东方电缆材料有限公司 2018-11-16 CN claimed
CN-108822469-A A kind of environmental-friendly halogen-free low-smoke high fire-retardance protective cover material 江苏东方电缆材料有限公司 2018-11-16 CN disclosed
EP-0660707-A4 METHOD OF PREVENTING NMDA RECEPTOR-MEDIATED NEURONAL DAMAGE. CHILDRENS MEDICAL CENTER (US) 1998-05-13 EP disclosed
EP-0660707-A1 METHOD OF PREVENTING NMDA RECEPTOR-MEDIATED NEURONAL DAMAGE The Children's Medical Center Corporation (US) 1995-07-05 EP disclosed
WO-1994005275-A9 METHOD OF PREVENTING NMDA RECEPTOR-MEDIATED NEURONAL DAMAGE 1994-04-28 WO disclosed
WO-1994005275-A1 METHOD OF PREVENTING NMDA RECEPTOR-MEDIATED NEURONAL DAMAGE THE CHILDREN'S MEDICAL CENTER CORPORATION (US) 1994-03-17 WO disclosed