SCHEMBL486386

SCHEMBL486386

C#CCOC(=O)[C@@H](N)CO

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 2/20 0.41
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
NPC1 O15118 1/20 0.38
CA12 O43570 1/20 0.35
CA1 P00915 1/20 0.35
CA2 P00918 1/20 0.35
CA9 Q16790 1/20 0.35
CA14 Q9ULX7 1/20 0.35
GRIK1 P39086 2/20 0.34
GRIK2 Q13002 2/20 0.34
POLB P06746 1/20 0.32
GSTP1 P09211 1/20 0.32
TSHR P16473 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
SCHEMBL486384 1.00 SLC1A1 (0.41) SLC1A1SLC1A3SLC1A2NPC1CA12
SCHEMBL27746031 0.81 PTGS1 (0.43) SLC1A1SLC1A3SLC1A2NPC1CA12
SCHEMBL13884459 0.81 SLC1A3 (0.40) SLC1A1SLC1A3SLC1A2NPC1CA12
SCHEMBL27892486 0.81 SLC1A3 (0.40) SLC1A1SLC1A3SLC1A2NPC1CA12
SCHEMBL30237674 0.78 SLC1A2 (0.41) SLC1A1SLC1A3SLC1A2
SCHEMBL21590082 0.78 SLC1A3 (0.38) SLC1A1SLC1A3SLC1A2NPC1CA12
SCHEMBL21590074 0.78 SLC1A3 (0.38) SLC1A1SLC1A3SLC1A2NPC1CA12
SCHEMBL14616106 0.77 SLC1A1 (0.42) SLC1A1SLC1A3SLC1A2NPC1GRIK1
SCHEMBL15509381 0.76 GSTP1 (0.41) SLC1A1SLC1A3SLC1A2NPC1CA12
SCHEMBL1661419 0.76 GSTP1 (0.41) SLC1A1SLC1A3SLC1A2NPC1CA12

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-2411404-A1 DIFFERENTIALLY PROTECTED ORTHOGONAL LANTHIONINE TECHNOLOGY Oragenics, Inc. (US) 2012-02-01 EP disclosed
WO-2010117652-A1 DIFFERENTIALLY PROTECTED ORTHOGONAL LANTHIONINE TECHNOLOGY ORAGENICS, INC. (US) 2010-10-14 WO disclosed