SCHEMBL3102882

SCHEMBL3102882

CC(O)C(NCP(=O)(O)O)C(N)=O

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 5/20 0.32
LAP3 P28838 4/20 0.32
ERAP1 Q9NZ08 1/20 0.32
PGD P52209 1/20 0.32
ALDH1A1 P00352 2/20 0.31
TDP1 Q9NUW8 1/20 0.31
MMP1 P03956 1/20 0.31
MMP8 P22894 1/20 0.31

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
SCHEMBL3102891 1.00 ANPEP (0.32) ANPEPLAP3ERAP1PGDALDH1A1
SCHEMBL3100531 0.86 LAP3 (0.37) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL3100524 0.86 LAP3 (0.37) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL2985648 0.82 PGK1 (0.35) LAP3ALDH1A1
SCHEMBL2817677 0.82 PGK1 (0.35) LAP3ALDH1A1
SCHEMBL2817679 0.82 PGK1 (0.35) LAP3ALDH1A1
SCHEMBL3097247 0.81 ENPEP (0.37) ANPEPLAP3ALDH1A1MMP1MMP8
SCHEMBL3097239 0.81 ENPEP (0.37) ANPEPLAP3ALDH1A1MMP1MMP8
SCHEMBL3099197 0.78 ANPEP (0.35) ANPEPLAP3ERAP1ALDH1A1TDP1
SCHEMBL3099206 0.78 ANPEP (0.35) ANPEPLAP3ERAP1ALDH1A1TDP1

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-20100247463-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2010-09-30 US claimed