SCHEMBL3097247

SCHEMBL3097247

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

nearest known ligand 0.37

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ENPEP Q07075 4/20 0.37
LAP3 P28838 1/20 0.36
ALDH1A1 P00352 1/20 0.36
MMP1 P03956 2/20 0.35
MMP2 P08253 2/20 0.35
METAP1 P53582 1/20 0.35
MMP3 P08254 1/20 0.35
CA2 P00918 3/20 0.33
CA1 P00915 2/20 0.33
CA12 O43570 1/20 0.32
MMP8 P22894 1/20 0.32
CA9 Q16790 1/20 0.32
L3MBTL1 Q9Y468 2/20 0.32
CNR2 P34972 1/20 0.31
FPR2 P25090 1/20 0.31
HTT P42858 1/20 0.31
ANPEP P15144 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
SCHEMBL3097239 1.00 ENPEP (0.37) ENPEPLAP3ALDH1A1MMP1MMP2
SCHEMBL2991878 0.85 ALDH1A1 (0.50) ENPEPALDH1A1MMP1MMP2MMP3
SCHEMBL2991880 0.85 ALDH1A1 (0.50) ENPEPALDH1A1MMP1MMP2MMP3
SCHEMBL3100524 0.83 LAP3 (0.37) LAP3ALDH1A1MMP1MMP2METAP1
SCHEMBL3100531 0.83 LAP3 (0.37) LAP3ALDH1A1MMP1MMP2METAP1
SCHEMBL3102891 0.81 ANPEP (0.32) LAP3ALDH1A1MMP1MMP8ANPEP
SCHEMBL3102882 0.81 ANPEP (0.32) LAP3ALDH1A1MMP1MMP8ANPEP
SCHEMBL3102486 0.80 FPR2 (0.44) ENPEPALDH1A1CA2CA1CA12
SCHEMBL30700134 0.79 ALDH1A1 (0.41) ENPEPALDH1A1CA2CA1L3MBTL1
SCHEMBL7273942 0.76 ENPEP (0.39) ENPEPALDH1A1L3MBTL1

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