SCHEMBL3082977

SCHEMBL3082977

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

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
OTC P00480 1/20 0.46
GSR P00390 1/20 0.42
ARG2 P78540 4/20 0.39
ARG1 P05089 3/20 0.39
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
GLUL P15104 1/20 0.37
DDAH1 O94760 1/20 0.37
GRM8 O00222 1/20 0.36
GRM6 O15303 1/20 0.36
GRM7 Q14831 1/20 0.36
GRM4 Q14833 1/20 0.36

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
SCHEMBL3204837 0.82 FOLH1 (0.33)
SCHEMBL16061010 0.79 GSR (0.52) OTCGSRARG2ARG1DDAH1
SCHEMBL29485083 0.77 GSR (0.61) OTCGSRARG2ARG1DDAH1
SCHEMBL2992563 0.76 OTC (0.55) OTCGSRARG2ARG1POLB
SCHEMBL7974900 0.76 GSR (0.48) OTCGSRARG2ARG1DDAH1
SCHEMBL25724508 0.76 GSR (0.48) OTCGSRARG2ARG1DDAH1
SCHEMBL934762 0.76 GSR (0.48) OTCGSRARG2ARG1DDAH1
Hydrochloric Acid SCHEMBL7974008 0.75 GSR (0.47) OTCGSRARG2ARG1DDAH1
Hydrochloric Acid SCHEMBL4581849 0.75 GSR (0.47) OTCGSRARG2ARG1DDAH1
Hydrochloric Acid SCHEMBL4424849 0.75 GSR (0.47) OTCGSRARG2ARG1DDAH1

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 7 patents. 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 disclosed
US-7776844-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2010-08-17 US disclosed
US-20090208499-A1 N-(Phosphonoalkyl)-Amino Acids, Derivatives Thereof and Compositions and Methods of Use YU RUEY J 2009-08-20 US disclosed
US-7572776-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2009-08-11 US disclosed
US-20080306025-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2008-12-11 US disclosed
US-7429575-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2008-09-30 US disclosed
US-20070161543-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2007-07-12 US disclosed