SCHEMBL14458882

SCHEMBL14458882

N[C@H](CC(Cc1c[nH]c2ccccc12)C(=O)O)C(=O)O

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.77
MAPT P10636 3/20 0.77
KMT2A Q03164 3/20 0.77
LMNA P02545 2/20 0.77
TSHR P16473 2/20 0.77
BLM P54132 2/20 0.77
PMP22 Q01453 2/20 0.77
MEN1 O00255 1/20 0.77
MPO P05164 1/20 0.77
HIF1A Q16665 1/20 0.77
SMN1; SMN2 Q16637 1/20 0.62
APAF1 O14727 1/20 0.60
POLB P06746 1/20 0.60
RECQL P46063 1/20 0.60
L3MBTL1 Q9Y468 1/20 0.60
SLC1A3 P43003 1/20 0.56
SLC1A2 P43004 1/20 0.56
SLC1A1 P43005 1/20 0.56
HTR2A P28223 3/20 0.55
HTR1A P08908 2/20 0.55

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
SCHEMBL4628875 1.00 KDM4E (0.77) KDM4EMAPTKMT2ALMNATSHR
SCHEMBL13762546 1.00 KDM4E (0.77) KDM4EMAPTKMT2ALMNATSHR
SCHEMBL3873866 0.90 KMT2A (0.70) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL475350 0.87 KMT2A (1.00) KDM4EMAPTKMT2ALMNATSHR
Dl-Tryptophan SCHEMBL19161120 0.87 KMT2A (1.00) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL23141133 0.87 KMT2A (1.00) KDM4EMAPTKMT2ALMNATSHR
Dl-Tryptophan SCHEMBL475349 0.87 KMT2A (1.00) KDM4EMAPTKMT2ALMNATSHR
Dl-Tryptophan SCHEMBL7327 0.87 KMT2A (1.00) KDM4EMAPTKMT2ALMNATSHR
Tryptophan SCHEMBL4732053 0.87 KMT2A (1.00) KDM4EMAPTKMT2ALMNATSHR
Dl-Tryptophan SCHEMBL4732052 0.87 KMT2A (1.00) KDM4EMAPTKMT2ALMNATSHR

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
US-7244462-B2 Amino acid derivative and sweetening agent AJINOMOTO CO., INC. (JP) 2007-07-17 US disclosed
US-7244462-B2 Amino acid derivative and sweetening agent AJINOMOTO CO., INC. (JP) 2007-07-17 US disclosed