SCHEMBL7746091

SCHEMBL7746091

N[C@H](CC1=CN=C2CC=CC=C12)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 4/20 0.35
PKM P14618 2/20 0.35
ALPI P09923 1/20 0.35
PTGS1 P23219 1/20 0.35
XIAP P98170 1/20 0.35
GRIA1 P42261 3/20 0.35
GRIA2 P42262 3/20 0.35
GRIA3 P42263 3/20 0.35
GRIA4 P48058 3/20 0.35
HSD17B10 Q99714 2/20 0.33
CYP3A4 P08684 2/20 0.33
CYP1A2 P05177 1/20 0.33
SLC1A3 P43003 1/20 0.33
USP2 O75604 2/20 0.33
RGS12 O14924 1/20 0.33
CYP2C9 P11712 1/20 0.33
ALOX15 P16050 1/20 0.33
NFKB1 P19838 1/20 0.33
CASP1 P29466 1/20 0.33
BRCA1 P38398 1/20 0.33

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
SCHEMBL4918514 0.72 SLC7A5 (0.40) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL13031142 0.71 SLC7A5 (0.44) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL13031137 0.71 SLC7A5 (0.44) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL7746093 0.70 SLC7A5 (0.36) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL6046223 0.70 SLC7A5 (0.36) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL7746085 0.70 SLC7A5 (0.36) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL3142493 0.65 SLC7A5 (0.48) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL29421912 0.63 SLC7A5 (0.43) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL9611983 0.62 SLC7A5 (0.42) SLC7A5PKMALPIPTGS1XIAP
SCHEMBL25660543 0.61 GRIA1 (0.42) SLC7A5PKMALPIPTGS1XIAP

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1067950-A4 NEO-TRYPTOPHAN MAYO FOUNDATION FOR MEDICAL (US) 2001-09-05 EP disclosed
EP-1067950-A1 NEO-TRYPTOPHAN MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2001-01-17 EP disclosed
WO-1999052539-A1 NEO-TRYPTOPHAN MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 1999-10-21 WO disclosed