SCHEMBL19034951

SCHEMBL19034951

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

nearest known ligand 0.58

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ NOD1 Q9Y239 8/20 0.58
▸ GNPAT O15228 1/20 0.46
▸ SLC6A5 Q9Y345 1/20 0.45
▸ GLP1R P43220 5/20 0.45
▸ FOLH1 Q04609 3/20 0.45
▸ RIMKLA Q8IXN7 1/20 0.44
▸ NAALAD2 Q9Y3Q0 1/20 0.44

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
SCHEMBL21243008 0.92 NOD1 (0.56) NOD1GNPATSLC6A5GLP1RFOLH1
SCHEMBL17724632 0.90 NOD1 (0.74) NOD1SLC6A5GLP1R
SCHEMBL19776963 0.90 NOD1 (0.59) NOD1GNPATSLC6A5GLP1RFOLH1
SCHEMBL21242674 0.90 NOD1 (0.59) NOD1GNPATSLC6A5GLP1RFOLH1
SCHEMBL14167624 0.90 NOD1 (0.59) NOD1GNPATSLC6A5GLP1RFOLH1
SCHEMBL24178469 0.90 NOD1 (0.59) NOD1GNPATSLC6A5GLP1RFOLH1
SCHEMBL21242900 0.90 NOD1 (0.59) NOD1GNPATSLC6A5GLP1RFOLH1
SCHEMBL25978049 0.89 NOD1 (0.58) NOD1SLC6A5GLP1R
SCHEMBL17682348 0.88 NOD1 (0.52) NOD1SLC6A5GLP1RFOLH1
SCHEMBL21418066 0.88 NOD1 (0.47) NOD1GLP1RFOLH1

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-9688737-B2 Protease stabilized acylated insulin analogues NOVO NORDISK A/S (DK) 2017-06-27 — — US disclosed
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