SCHEMBL3087573

SCHEMBL3087573

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

nearest known ligand 0.36

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 3/20 0.36
FDPS P14324 2/20 0.35
METAP1 P53582 1/20 0.35
MMP1 P03956 2/20 0.32
MMP2 P08253 2/20 0.32
MMP3 P08254 2/20 0.32
MMP8 P22894 1/20 0.31
ANPEP P15144 3/20 0.31
ERAP1 Q9NZ08 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
SCHEMBL3087571 1.00 LAP3 (0.36) LAP3FDPSMETAP1MMP1MMP2
SCHEMBL3098133 0.85 LAP3 (0.38) LAP3FDPSANPEPERAP1
SCHEMBL3098142 0.85 LAP3 (0.38) LAP3FDPSANPEPERAP1
SCHEMBL2985696 0.84 FDPS (0.36) LAP3FDPSMETAP1MMP1MMP2
SCHEMBL2985694 0.84 FDPS (0.36) LAP3FDPSMETAP1MMP1MMP2
SCHEMBL3100608 0.81 FDPS (0.33) LAP3FDPSANPEPERAP1
SCHEMBL3100596 0.81 FDPS (0.33) LAP3FDPSANPEPERAP1
SCHEMBL8613007 0.79 PGR (0.36) FDPS
Hydrochloric Acid SCHEMBL8615965 0.77 PGR (0.35) FDPS
SCHEMBL3109138 0.75 FDPS (0.37) LAP3FDPSMETAP1MMP1MMP2

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