SCHEMBL6893763

SCHEMBL6893763

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.42
NOS1 P29475 2/20 0.37
NOS3 P29474 1/20 0.37
NOS2 P35228 1/20 0.37
SLC1A1 P43005 2/20 0.34
HDAC1 Q13547 2/20 0.34
HDAC2 Q92769 2/20 0.34
HDAC6 Q9UBN7 2/20 0.34
HDAC3 O15379 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
CYP1A2 P05177 2/20 0.32
GRM8 O00222 1/20 0.32
GRM6 O15303 1/20 0.32
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GSR P00390 1/20 0.32
GRIK1 P39086 1/20 0.32
GRM5 P41594 1/20 0.32
GRIA1 P42261 1/20 0.32
GRIA2 P42262 1/20 0.32

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
SCHEMBL1841835 0.98 LTA4H (0.43) LTA4HNOS1NOS3NOS2SLC1A1
SCHEMBL1654337 0.98 LTA4H (0.43) LTA4HNOS1NOS3NOS2SLC1A1
SCHEMBL18477 0.98 LTA4H (0.43) LTA4HNOS1NOS3NOS2SLC1A1
Hydrochloric Acid SCHEMBL4654220 0.96 LTA4H (0.42) LTA4HNOS1NOS3NOS2SLC1A1
Hydrochloric Acid SCHEMBL1517836 0.96 LTA4H (0.42) LTA4HNOS1NOS3NOS2SLC1A1
Water SCHEMBL27596082 0.96 LTA4H (0.42) LTA4HNOS1NOS3NOS2SLC1A1
Hydrochloric Acid SCHEMBL18476 0.96 LTA4H (0.42) LTA4HNOS1NOS3NOS2SLC1A1
Water SCHEMBL3912787 0.96 LTA4H (0.42) LTA4HNOS1NOS3NOS2SLC1A1
SCHEMBL18744647 0.88 LTA4H (0.40) LTA4HNOS1NOS3NOS2SLC1A1
SCHEMBL23416460 0.87 LTA4H (0.39) LTA4HNOS1NOS3NOS2SLC1A1

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-1385498-A2 MEDIUM-CHAIN LENGTH FATTY ACIDS, GLYCERIDES AND ANALOGUES AS NEUTROPHIL SURVIVAL AND ACTIVATION FACTORS Prometic Biosciences Inc. (CA) 2004-02-04 EP disclosed
WO-2002083120-A2 MEDIUM-CHAIN LENGTH FATTY ACIDS, GLYCERIDES AND ANALOGUES AS NEUTROPHIL SURVIVAL AND ACTIVATION FACTORS PROMETIC BIOSCIENCES INC. (CA) 2002-10-24 WO disclosed