SCHEMBL15524955

SCHEMBL15524955

O=[C][C@H](CC(=O)O)NC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 7/20 0.54
GNPAT O15228 1/20 0.44
FOLH1 Q04609 2/20 0.44
RIMKLA Q8IXN7 1/20 0.42
NAALAD2 Q9Y3Q0 1/20 0.42
GART P22102 3/20 0.41
EPHX2 P34913 1/20 0.40
GLP1R P43220 3/20 0.40

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
SCHEMBL19049823 0.83 NOD1 (0.68) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL14167445 0.83 NOD1 (0.68) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL14167660 0.83 NOD1 (0.68) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL19049830 0.83 NOD1 (0.68) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL19034801 0.82 NOD1 (0.65) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL13753507 0.82 NOD1 (0.65) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL14167625 0.82 NOD1 (0.65) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL19049828 0.82 NOD1 (0.65) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL4407799 0.82 NOD1 (0.65) NOD1GNPATFOLH1RIMKLANAALAD2
SCHEMBL19049826 0.82 NOD1 (0.65) NOD1GNPATFOLH1RIMKLANAALAD2

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-2838914-A1 HUMAN AMYLIN ANALOGUES Novo Nordisk A/S (DK) 2015-02-25 EP disclosed
WO-2013156594-A1 HUMAN AMYLIN ANALOGUES NOVO NORDISK A/S (DK) 2013-10-24 WO disclosed