SCHEMBL3098115

SCHEMBL3098115

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

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FDPS P14324 6/20 0.42
METAP1 P53582 2/20 0.41
LAP3 P28838 3/20 0.36
ANPEP P15144 1/20 0.34
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
S1PR2 O95136 3/20 0.33
S1PR1 P21453 3/20 0.33
S1PR3 Q99500 3/20 0.33
S1PR4 O95977 2/20 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
SCHEMBL3098107 1.00 FDPS (0.42) FDPSMETAP1LAP3ANPEPCA1
SCHEMBL4341296 0.85 LAP3 (0.40) FDPSMETAP1LAP3ANPEPCA1
SCHEMBL3098289 0.83 MME (0.32)
SCHEMBL2989561 0.83 FDPS (0.43) FDPSMETAP1CA2
SCHEMBL3098286 0.83 MME (0.32)
SCHEMBL2989560 0.83 FDPS (0.43) FDPSMETAP1CA2
SCHEMBL3090768 0.82 METAP2 (0.33) FDPSMETAP1
SCHEMBL3090764 0.82 METAP2 (0.33) FDPSMETAP1
SCHEMBL3098192 0.81 ENPEP (0.33)
SCHEMBL2991077 0.81 KMT2A (0.35) CA1CA2

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