SCHEMBL8769205

SCHEMBL8769205

C[C@@H](O)[C@H](NP(=O)(O)OCO)C(=O)O

nearest known ligand 0.36

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MME P08473 3/20 0.36
ECE1 P42892 2/20 0.36
PGK1 P00558 1/20 0.35
PGK2 P07205 1/20 0.35
GGH Q92820 1/20 0.34
LAP3 P28838 3/20 0.33
PGD P52209 1/20 0.33
ALDH1A1 P00352 1/20 0.33
FOLH1 Q04609 2/20 0.32
CA2 P00918 2/20 0.31
CA1 P00915 1/20 0.31
PDCD1LG2 Q9BQ51 1/20 0.30
CD274 Q9NZQ7 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
SCHEMBL42674 0.75 TP53 (0.38) MMEECE1GGHLAP3CA2
SCHEMBL42677 0.75 TP53 (0.38) MMEECE1GGHLAP3CA2
SCHEMBL29941107 0.75 ALDH1A1 (0.41) MMEECE1PGK1PGK2LAP3
SCHEMBL6513519 0.71 GGH (0.37) MMEECE1GGHLAP3CA2
SCHEMBL8851847 0.71 ALDH1A1 (0.39) MMEECE1PGK1PGK2LAP3
Glycine SCHEMBL10277141 0.70 GLRA1 (0.36) MMEECE1GGHLAP3CA2
Glycine SCHEMBL10277137 0.70 GLRA1 (0.36) MMEECE1GGHLAP3CA2
SCHEMBL7547247 0.70 TP53 (0.36) MMEALDH1A1CA2CA1
SCHEMBL2817679 0.67 PGK1 (0.35) MMEECE1PGK1PGK2LAP3
SCHEMBL769620 0.67 PGK1 (0.35) MMEECE1PGK1PGK2LAP3

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
EP-0792146-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-09-03 EP disclosed
WO-1997002028-A1 INACTIVATION OF PATHOGENS USING HYDROXYMETHYLAMINES HEMASURE, INC. (US) 1997-01-23 WO disclosed