SCHEMBL8712673

SCHEMBL8712673

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

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.37
ECE1 P42892 1/20 0.31
SLC15A1 P46059 1/20 0.31
SLC1A3 P43003 1/20 0.31
SLC1A2 P43004 1/20 0.31
SLC1A1 P43005 1/20 0.31
DPP4 P27487 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
SCHEMBL7863894 0.87 PDCD1LG2 (0.31)
SCHEMBL27906557 0.85 ALOX15 (0.36)
SCHEMBL995487 0.85 ALOX15 (0.36)
SCHEMBL11061010 0.85 ALOX15 (0.36)
Valine SCHEMBL3443442 0.84 SLC7A5 (0.44) SLC7A5ECE1SLC15A1SLC1A3SLC1A2
SCHEMBL8679062 0.84 CHRNB2 (0.33) SLC7A5
SCHEMBL14486118 0.84 CHRNB2 (0.33) SLC7A5
SCHEMBL3194064 0.84 DPP4 (0.37) DPP4
SCHEMBL6130798 0.82 SLC7A5 (0.48) SLC7A5SLC1A3SLC1A2SLC1A1
SCHEMBL4775852 0.82 SLC7A5 (0.48) SLC7A5SLC1A3SLC1A2SLC1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5723504-A RACTION OF AMINE WITH SUGAR AND FORMING A KETONE AMINO SUGAR DERIVATIVE TORF ESTABLISHMENT (LI) 1998-03-03 US claimed
EP-0368920-A1 LECTINES FIXING BETA-D-GALACTOSIDE. IDEON CORP (US) 1990-05-23 EP claimed
WO-1989000581-A1 LECTINES FIXING BETA-D-GALACTOSIDE IDEON CORPORATION (US) 1989-01-26 WO claimed
EP-3737420-A2 STEROIDS AND ANTIBODY-CONJUGATES THEREOF Regeneron Pharmaceuticals, Inc. (US) 2020-11-18 EP disclosed
WO-2019136487-A2 STEROIDS AND ANTIBODY-CONJUGATES THEREOF REGENERON PHARMACEUTICALS, INC. (US) 2019-07-11 WO disclosed
EP-0885880-A2 Sulfonylalkanoylamino hydroxyethylamino sulfamic acids useful as retroviral protease inhibitors G.D. SEARLE & CO. (US) 1998-12-23 EP disclosed
EP-0368920-A1 LECTINES FIXING BETA-D-GALACTOSIDE. IDEON CORP (US) 1990-05-23 EP disclosed
WO-1989000581-A1 LECTINES FIXING BETA-D-GALACTOSIDE IDEON CORPORATION (US) 1989-01-26 WO disclosed