SCHEMBL8530260

SCHEMBL8530260

CC(CC(=O)C(Cc1ccccc1)C(=O)O)C[C@H](N)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 3/20 0.56
SLC1A3 P43003 2/20 0.56
SLC1A2 P43004 2/20 0.56
ALPI P09923 1/20 0.56
PKM P14618 1/20 0.56
PTGS1 P23219 1/20 0.56
XIAP P98170 1/20 0.56
SLC7A5 Q01650 1/20 0.56
ANPEP P15144 1/20 0.55
RNPEP Q9H4A4 1/20 0.55
DNPEP Q9ULA0 1/20 0.55
SLC15A1 P46059 1/20 0.49
LTA4H P09960 2/20 0.47
GRIK1 P39086 2/20 0.44
SLC6A2 P23975 2/20 0.43
TAAR1 Q96RJ0 2/20 0.43
MAOA P21397 1/20 0.43
SLC6A4 P31645 1/20 0.43
SLC6A3 Q01959 1/20 0.43
SIGMAR1 Q99720 1/20 0.43

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
SCHEMBL9341151 0.90 SLC7A5 (0.62) SLC1A1SLC1A3SLC1A2ALPIPKM
SCHEMBL27170852 0.90 SLC7A5 (0.62) SLC1A1SLC1A3SLC1A2ALPIPKM
SCHEMBL9502304 0.85 SLC1A3 (0.52) SLC1A1SLC1A3SLC1A2ALPIPKM
SCHEMBL16782428 0.85 SLC1A3 (0.52) SLC1A1SLC1A3SLC1A2ALPIPKM
SCHEMBL28951729 0.80 SLC1A1 (0.54) SLC1A1SLC1A3SLC1A2ALPIPKM
SCHEMBL6033432 0.79 SLC1A1 (0.51) SLC1A1SLC1A3SLC1A2ALPIPKM
SCHEMBL8932133 0.79 GRM2 (0.51) SLC1A1SLC1A3SLC1A2ALPIPKM
SCHEMBL11148099 0.78 TSHR (0.53) SLC1A1SLC1A3SLC1A2ALPIPKM
SCHEMBL23834058 0.77 ANPEP (0.52) SLC1A1SLC1A3SLC1A2ALPIPKM
Dl-Phenylalanine SCHEMBL208388 0.76 SLC7A5 (0.76) SLC1A1SLC1A3SLC1A2ALPIPKM

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-5945033-A ALBUMIN, HEMOGLOBIN MIXTURE; STABILITY HEMOSPHERE, INC. (US) 1999-08-31 US disclosed
US-5725804-A ALBUMIN PARTICLES STABLE TO RESOLUBILIZATION, POLYOXYETHYLENE GLYCOL, ALCOHOL HEMOSPHERE, INC. (US) 1998-03-10 US disclosed