SCHEMBL20215727

SCHEMBL20215727

CCCCNC(=O)CC[C@H](NC(=O)CC[C@H](NC(=O)CCCNC(=O)CC[C@H](NC(=O)CCCCCCCCCCCCCCCCC(=O)O)C(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 6/20 0.69
▸ GLP1R P43220 8/20 0.60
▸ EPHX2 P34913 4/20 0.55
▸ KDM4E B2RXH2 1/20 0.54

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
SCHEMBL20215725 1.00 NOD1 (0.69) NOD1GLP1REPHX2KDM4E
SCHEMBL19786616 1.00 NOD1 (0.69) NOD1GLP1REPHX2KDM4E
SCHEMBL20146988 0.99 NOD1 (0.71) NOD1GLP1REPHX2
SCHEMBL20146950 0.99 NOD1 (0.71) NOD1GLP1REPHX2
SCHEMBL21966296 0.99 NOD1 (0.71) NOD1GLP1REPHX2
SCHEMBL20146943 0.99 NOD1 (0.71) NOD1GLP1REPHX2
SCHEMBL12686627 0.99 NOD1 (0.71) NOD1GLP1REPHX2
SCHEMBL13922028 0.99 NOD1 (0.71) NOD1GLP1REPHX2
SCHEMBL24390404 0.96 NOD1 (0.72) NOD1GLP1REPHX2
SCHEMBL16144791 0.96 NOD1 (0.72) NOD1GLP1REPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9988430-B2 Stable GLP-1 based GLP-1/glucagon receptor co-agonists NOVO NORDISK A/S (DK) 2018-06-05 — — US disclosed
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