SCHEMBL3083186

SCHEMBL3083186

C=CC(N[C@@H](CCC(N)=O)C(=O)O)P(=O)(O)O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 6/20 0.40
CA1 P00915 4/20 0.40
GGH Q92820 2/20 0.37
KMT2A Q03164 3/20 0.37
BLM P54132 2/20 0.37
ALOX15 P16050 1/20 0.37
PMP22 Q01453 1/20 0.37
MMP2 P08253 2/20 0.35
MMP9 P14780 2/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
MME P08473 1/20 0.32
ECE1 P42892 1/20 0.32
FOLH1 Q04609 2/20 0.32
RIMKLA Q8IXN7 1/20 0.32
NAALAD2 Q9Y3Q0 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
MEN1 O00255 1/20 0.32
CYP2D6 P10635 1/20 0.32

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
SCHEMBL3083184 1.00 CA2 (0.40) CA2CA1GGHKMT2ABLM
SCHEMBL3093818 0.88 GGH (0.50) CA2CA1GGHKMT2ABLM
SCHEMBL3093805 0.88 GGH (0.50) CA2CA1GGHKMT2ABLM
SCHEMBL3090638 0.84 CA2 (0.38) CA2CA1KMT2AECE1FOLH1
SCHEMBL3090633 0.84 CA2 (0.38) CA2CA1KMT2AECE1FOLH1
SCHEMBL3089817 0.83 CA2 (0.33) CA2GGHFOLH1CA4GRIN2D
SCHEMBL3089813 0.83 CA2 (0.33) CA2GGHFOLH1CA4GRIN2D
SCHEMBL3083360 0.82 FOLH1 (0.38) CA2CA1GGHBLMPMP22
SCHEMBL3083363 0.82 FOLH1 (0.38) CA2CA1GGHBLMPMP22
Phosphoric Acid SCHEMBL27542272 0.82 KMT2A (0.41) CA2CA1GGHKMT2ABLM

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 9 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
EP-1979366-A2 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE Yu, Ruey J. (US) 2008-10-15 EP disclosed
US-7429575-B2 N-(phosphonoalkyl)-amino acids, derivatives thereof and compositions and methods of use YU RUEY J 2008-09-30 US disclosed
WO-2007082206-A2 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J (US) 2007-07-19 WO disclosed
US-20070161543-A1 N-(PHOSPHONOALKYL)-AMINO ACIDS, DERIVATIVES THEREOF AND COMPOSITIONS AND METHODS OF USE YU RUEY J 2007-07-12 US disclosed