SCHEMBL9468613

SCHEMBL9468613

NC(/C=C\CCO)C(=O)O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTH P32929 1/20 0.42
LMNA P02545 1/20 0.41
CA1 P00915 1/20 0.37
CA9 Q16790 1/20 0.37
ARG2 P78540 1/20 0.34
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
GRM2 Q14416 1/20 0.31
GRM3 Q14832 1/20 0.31
GRM8 O00222 1/20 0.31
SLC1A1 P43005 1/20 0.31
PTGS1 P23219 1/20 0.31
SLC7A11 Q9UPY5 1/20 0.31
HDAC2 Q92769 1/20 0.31
USP2 O75604 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
SCHEMBL13319935 1.00 CTH (0.42) CTHLMNACA1CA9ARG2
SCHEMBL9467576 1.00 CTH (0.42) CTHLMNACA1CA9ARG2
SCHEMBL9468033 0.82 CA1 (0.37) CA1CA9
SCHEMBL9468548 0.82 CA1 (0.37) CA1CA9
SCHEMBL8617997 0.81
SCHEMBL8618000 0.81
SCHEMBL9785149 0.80 GRM8 (0.41) CTHLMNAGRIN2DGRIN3BGRIN1
SCHEMBL9785147 0.80 GRM8 (0.41) CTHLMNAGRIN2DGRIN3BGRIN1
SCHEMBL17667386 0.80 CTH (0.41) CTHLMNAARG2GRIN2DGRIN3B
SCHEMBL9467971 0.80 GRIK1 (0.43) CTHLMNAGRIN2DGRIN3BGRIN1

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
US-5208260-A Vinyl Glycine derivatives for memory and learning enhancement or treatment of a cognitive disorder G. D. SEARLE & CO. (US) 1993-05-04 US disclosed