SCHEMBL28367481

SCHEMBL28367481

O=C(O)CN(O)C(=O)C1CCCN1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCN4A P35499 1/20 0.41
NOS2 P35228 2/20 0.37
NOS3 P29474 1/20 0.37
NOS1 P29475 1/20 0.37
PRCP P42785 1/20 0.36
GLI1 P08151 1/20 0.36
DPP4 P27487 4/20 0.36
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
BLM P54132 1/20 0.35
DPP8 Q6V1X1 2/20 0.35
DPP9 Q86TI2 2/20 0.35
DPP7 Q9UHL4 2/20 0.34
FAP Q12884 1/20 0.34
CTSC P53634 1/20 0.33
ALDH1A1 P00352 1/20 0.33
CYP1A2 P05177 1/20 0.33
THRB P10828 1/20 0.33
ALOX15 P16050 1/20 0.33
CYP2C19 P33261 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
SCHEMBL3359438 0.84 SCN4A (0.42) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL29772688 0.81 SCN4A (0.47) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL8788154 0.81 SCN4A (0.47) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL8567463 0.76 SCN4A (0.37) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL7418916 0.73 SCN4A (0.45) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL490079 0.71 GLI1 (0.66) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL894617 0.71 GLI1 (0.66) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL29741418 0.71 SCN4A (0.46) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL255493 0.71 GLI1 (0.66) SCN4ANOS2NOS3NOS1PRCP
SCHEMBL5048080 0.70 SCN4A (0.46) SCN4ANOS2NOS3NOS1PRCP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106262576-B Salty taste enhancer 长谷川香料株式会社 2020-03-27 CN disclosed