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SCHEMBL21172278

SCHEMBL21172278

CCC(=O)NCCCCC(NC(=O)COCCOCCNC(=O)CCC(NC(=O)CCC(NC(=O)COCCOCCNC(=O)CCCS(=O)(=O)NC(=O)S)C(=O)O)C(=O)O)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.58
▸ CCKAR P32238 9/20 0.40
▸ CCKBR P32239 9/20 0.40
▸ NOD1 Q9Y239 3/20 0.38

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
SCHEMBL24179869 0.91 GLP1R (0.60) GLP1RCCKARCCKBRNOD1
SCHEMBL21172234 0.91 GLP1R (0.54) GLP1RCCKARCCKBRNOD1
SCHEMBL12424093 0.88 GLP1R (0.62) GLP1RCCKARCCKBRNOD1
SCHEMBL12518541 0.88 GLP1R (0.62) GLP1RCCKARCCKBRNOD1
SCHEMBL21127452 0.87 GLP1R (0.55) GLP1RCCKARCCKBRNOD1
SCHEMBL19261654 0.87 GLP1R (0.53) GLP1RCCKARCCKBRNOD1
SCHEMBL24179873 0.85 GLP1R (0.58) GLP1RCCKARCCKBRNOD1
SCHEMBL12519878 0.84 GLP1R (0.73) GLP1RCCKARCCKBRNOD1
SCHEMBL16218301 0.83 GLP1R (0.54) GLP1RCCKARCCKBRNOD1
SCHEMBL16180974 0.83 GLP1R (0.54) GLP1RCCKARCCKBRNOD1

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
EP-2525834-B1 GROWTH HORMONES WITH PROLONGED IN-VIVO EFFICACY NOVO NORDISK HEALTHCARE AG (CH) 2019-07-17 — — EP disclosed
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