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SCHEMBL13475019

SCHEMBL13475019

CN[C@@H](CCCCNC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CCCC(=O)NCCCCC(NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CN1CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC1)C(=O)NCCCC[C@H](NC)C(N)=O)C(N)=O

nearest known ligand 0.53

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.53
▸ FOLH1 Q04609 7/20 0.41
▸ GRPR P30550 3/20 0.40
▸ ALB P02768 1/20 0.38
▸ CCKAR P32238 1/20 0.37
▸ CCKBR P32239 1/20 0.37

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
SCHEMBL8122830 1.00 GLP1R (0.53) GLP1RFOLH1GRPRALBCCKAR
SCHEMBL8116094 0.97 GLP1R (0.51) GLP1RFOLH1GRPRALBCCKAR
SCHEMBL12972440 0.97 GLP1R (0.51) GLP1RFOLH1GRPRALBCCKAR
SCHEMBL12743484 0.92 GLP1R (0.53) GLP1RFOLH1GRPRALB
SCHEMBL8121657 0.91 GLP1R (0.51) GLP1RFOLH1GRPRALBCCKAR
SCHEMBL14367156 0.89 GLP1R (0.55) GLP1RFOLH1GRPRALBCCKAR
SCHEMBL12743509 0.89 GLP1R (0.51) GLP1RFOLH1GRPRALB
SCHEMBL14500447 0.89 GLP1R (0.49) GLP1RFOLH1GRPRALBCCKAR
SCHEMBL12767756 0.88 GLP1R (0.43) GLP1RFOLH1GRPRCCKARCCKBR
SCHEMBL14367158 0.86 GLP1R (0.52) GLP1RFOLH1GRPRCCKARCCKBR

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-7666979-B2 polyvalent targeting ligands that bind to cells used for diagnosis of diseases sensitivity to angiogenesis factor BRACCO INTERNATIONAL B.V. (NL) 2010-02-23 — — US disclosed