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SCHEMBL14422366

SCHEMBL14422366

C[C@@H](CCCCNC(=O)[C@H](CCCCNC(=O)CCCC(=O)NCCOCCOCC(=O)NCCOCCOCC(=O)NCCCCCC(N)=O)NC(=O)COCCOCCNC(=O)COCCOCCNC(=O)CN1CCN(CC(=O)O)CCN(CC(O)O)CCN(CC(=O)O)CC1)C(N)=O

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 8/20 0.52
▸ GRPR P30550 5/20 0.42
▸ FOLH1 Q04609 5/20 0.41
▸ CCKAR P32238 2/20 0.36
▸ CCKBR P32239 2/20 0.36

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
SCHEMBL14367156 0.96 GLP1R (0.55) GLP1RGRPRFOLH1CCKARCCKBR
SCHEMBL14367158 0.93 GLP1R (0.52) GLP1RGRPRFOLH1CCKARCCKBR
SCHEMBL12743484 0.93 GLP1R (0.53) GLP1RGRPRFOLH1
SCHEMBL12743509 0.90 GLP1R (0.51) GLP1RGRPRFOLH1
SCHEMBL14422367 0.87 GLP1R (0.48) GLP1RGRPRFOLH1CCKARCCKBR
SCHEMBL13475019 0.85 GLP1R (0.53) GLP1RGRPRFOLH1CCKARCCKBR
SCHEMBL8122830 0.85 GLP1R (0.53) GLP1RGRPRFOLH1CCKARCCKBR
SCHEMBL8121657 0.83 GLP1R (0.51) GLP1RGRPRFOLH1CCKARCCKBR
SCHEMBL8116094 0.82 GLP1R (0.51) GLP1RGRPRFOLH1CCKARCCKBR
SCHEMBL12972440 0.82 GLP1R (0.51) GLP1RGRPRFOLH1CCKARCCKBR

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-7261876-B2 Multivalent constructs for therapeutic and diagnostic applications BRACCO INTERNATIONAL BV (NL) 2007-08-28 — — US disclosed