SCHEMBL460263

SCHEMBL460263

CNP(=O)(O)OCC(O)CO

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 1/20 0.44
LPAR5 Q9H1C0 2/20 0.34
LMNA P02545 3/20 0.33
KDM4E B2RXH2 2/20 0.33
DUSP3 P51452 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
USP2 O75604 1/20 0.32
LPAR6 P43657 1/20 0.32
LPAR1 Q92633 1/20 0.32
LPAR4 Q99677 1/20 0.32
LPAR2 Q9HBW0 1/20 0.32
LPAR3 Q9UBY5 1/20 0.32
ENPP2 Q13822 1/20 0.32
PGK1 P00558 1/20 0.31
PGK2 P07205 1/20 0.31
SELP P16109 1/20 0.31
PGD P52209 1/20 0.31
ALDH1A1 P00352 1/20 0.31
AGTR1 P30556 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
SCHEMBL6815874 0.77 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL1698794 0.77 SMN1; SMN2 (0.38) SMN1; SMN2
SCHEMBL6262083 0.77 SMN1; SMN2 (0.43) SMN1; SMN2LPAR5LMNAKDM4EDUSP3
SCHEMBL14803320 0.77 SMN1; SMN2 (0.47) SMN1; SMN2LPAR5LMNAKDM4EDUSP3
SCHEMBL17715424 0.77 SMN1; SMN2 (0.47) SMN1; SMN2LPAR5LMNAKDM4EDUSP3
SCHEMBL9962912 0.77 SMN1; SMN2 (0.47) SMN1; SMN2LPAR5LMNAKDM4EDUSP3
SCHEMBL213379 0.76 PGK1 (0.52) SMN1; SMN2LPAR5LMNALPAR6LPAR1
SCHEMBL7340 0.76 PGK1 (0.52) SMN1; SMN2LPAR5LMNALPAR6LPAR1
SCHEMBL12284729 0.76 SMN1; SMN2 (0.46) SMN1; SMN2LPAR5LMNAKDM4EDUSP3
SCHEMBL14278848 0.76 PGK1 (0.52) SMN1; SMN2LPAR5LMNALPAR6LPAR1

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8575282-B2 Compound modified by a phosphoramidate and/or phosphonamide group and use thereof FREIE UNIVERSITAET BERLIN (DE) 2013-11-05 US disclosed
US-20120065344-A1 COMPOUND MODIFIED BY A PHOSPHORAMIDATE AND/OR PHOSPHONAMIDE GROUP AND USE THEREOF FREIE UNIVERSITAET BERLIN (DE) 2012-03-15 US disclosed