SCHEMBL3100554

SCHEMBL3100554

NC(=O)CC(C(N)=O)N(CP(=O)(O)O)CP(=O)(O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
FDPS P14324 1/20 0.30

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
SCHEMBL3091959 1.00 CA2 (0.31) CA2CA4FDPS
SCHEMBL2979501 0.86 FOLH1 (0.34) CA2CA4
SCHEMBL2979505 0.86 FOLH1 (0.34) CA2CA4
SCHEMBL3103343 0.82 FDPS (0.31) FDPS
SCHEMBL3103350 0.82 FDPS (0.31) FDPS
SCHEMBL3087550 0.81 ALOX15 (0.35)
SCHEMBL3098026 0.81 ALOX15 (0.35)
SCHEMBL3109104 0.80 ENPEP (0.35) FDPS
SCHEMBL3109099 0.80 ENPEP (0.35) FDPS
SCHEMBL3095753 0.78 ALDH1A1 (0.31)

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