SCHEMBL27593304

SCHEMBL27593304

COC(=O)C(OC)C(N)C(=O)OC(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
NOS1 P29475 2/20 0.38
NOS3 P29474 1/20 0.38
NOS2 P35228 1/20 0.38
CA12 O43570 1/20 0.37
CA14 Q9ULX7 1/20 0.37
DGAT1 O75907 1/20 0.36
SMN1; SMN2 Q16637 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
SCHEMBL16392545 0.92 SLC1A3 (0.41) SLC1A3SLC1A2SLC1A1NOS1NOS3
SCHEMBL3240752 0.84 NOS1 (0.41) SLC1A3SLC1A2SLC1A1NOS1NOS3
Hydrochloric Acid SCHEMBL28773975 0.82 NOS1 (0.41) SLC1A3SLC1A2SLC1A1NOS1NOS3
SCHEMBL28062530 0.79 NOS1 (0.46) SLC1A3SLC1A2SLC1A1NOS1NOS3
Hydrochloric Acid SCHEMBL8848963 0.77 NOS1 (0.45) SLC1A3SLC1A2SLC1A1NOS1NOS3
SCHEMBL318908 0.76 NOS1 (0.43) SLC1A3SLC1A2SLC1A1NOS1NOS3
SCHEMBL318907 0.76 NOS1 (0.43) SLC1A3SLC1A2SLC1A1NOS1NOS3
SCHEMBL12549336 0.76 NOS1 (0.43) SLC1A3SLC1A2SLC1A1NOS1NOS3
SCHEMBL17775437 0.76 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1NOS1NOS3
SCHEMBL311538 0.76 SLC1A3 (0.39) SLC1A3SLC1A2SLC1A1NOS1NOS3

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-1437581-A Glucagon antagonists/inverse agonists NOVO NORDISK AS (DK) 2003-08-20 CN disclosed