SCHEMBL2850332

SCHEMBL2850332

NC(CCC(=O)c1ccccc1)C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.55
MAPT P10636 3/20 0.53
TDP1 Q9NUW8 3/20 0.53
L3MBTL1 Q9Y468 2/20 0.53
LMNA P02545 1/20 0.53
NR4A2 P43354 1/20 0.53
GRM8 O00222 1/20 0.52
GRM6 O15303 1/20 0.52
GRIN2D O15399 1/20 0.52
GRIN3B O60391 1/20 0.52
GSR P00390 1/20 0.52
CYP1A2 P05177 1/20 0.52
GRIK1 P39086 1/20 0.52
GRM5 P41594 1/20 0.52
GRIA1 P42261 1/20 0.52
GRIA2 P42262 1/20 0.52
GRIA3 P42263 1/20 0.52
SLC1A3 P43003 1/20 0.52
SLC1A2 P43004 1/20 0.52
SLC1A1 P43005 1/20 0.52

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
Alanine SCHEMBL28279098 0.93 LTA4H (0.50) LTA4HMAPTTDP1L3MBTL1LMNA
SCHEMBL2159293 0.89 TDP1 (0.60) LTA4HMAPTTDP1L3MBTL1LMNA
SCHEMBL28134771 0.86 TDP1 (0.67) LTA4HMAPTTDP1L3MBTL1LMNA
SCHEMBL29098319 0.85 NPC1 (0.55) TDP1L3MBTL1GRM8GRM6GRIN2D
SCHEMBL27717850 0.82 PLOD2 (0.55) TDP1LMNAGRM8GRM4KMT2A
Glutamic Acid SCHEMBL7773691 0.81 GRM4 (0.64) LTA4HNR4A2GRM8GRM6GRIN2D
D-Glutamate SCHEMBL7773686 0.81 GRM4 (0.64) LTA4HNR4A2GRM8GRM6GRIN2D
SCHEMBL9184944 0.81 L3MBTL1 (0.53) MAPTTDP1L3MBTL1LMNANR4A2
Glutamic Acid SCHEMBL28817932 0.80 GRM8 (0.62) LTA4HMAPTTDP1L3MBTL1NR4A2
D-Glutamate SCHEMBL28817934 0.80 GRM8 (0.62) LTA4HMAPTTDP1L3MBTL1NR4A2

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
WO-2010019469-A2 PREPARATION OF (S)-2-AMINOBUTYRIC ACID DR. REDDY'S LABORATORIES LTD. (IN) 2010-02-18 WO claimed