SCHEMBL30511103

SCHEMBL30511103

NCCCC[C@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC(N)=O)C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 7/20 0.48
▸ CCKAR P32238 4/20 0.48
▸ OPRD1 P41143 1/20 0.48
▸ PRMT1 Q99873 1/20 0.48
▸ UTS2R Q9UKP6 1/20 0.48
▸ PCSK9 Q8NBP7 1/20 0.47
▸ C5AR1 P21730 2/20 0.47
▸ CXCR4 P61073 3/20 0.47
▸ GHSR Q92847 3/20 0.46

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
SCHEMBL31003037 0.91 UTS2R (0.54) CCKBRUTS2RGHSR
SCHEMBL31267948 0.91 PRMT1 (0.49) CCKBRCCKAROPRD1PRMT1C5AR1
SCHEMBL30974064 0.90 GLP1R (0.50) CCKBRCCKAROPRD1C5AR1CXCR4
SCHEMBL30974480 0.89 CCKBR (0.50) CCKBRCCKAROPRD1PRMT1UTS2R
SCHEMBL30974091 0.89 C5AR1 (0.57) C5AR1CXCR4
SCHEMBL9390811 0.89 PRMT1 (0.53) CCKBRCCKAROPRD1PRMT1UTS2R
SCHEMBL9390818 0.89 PRMT1 (0.53) CCKBRCCKAROPRD1PRMT1UTS2R
SCHEMBL30511102 0.89 GLP1R (0.58) —
SCHEMBL30511100 0.89 GLP1R (0.58) —
SCHEMBL30974212 0.88 C5AR1 (0.56) C5AR1CXCR4

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
WO-2023139106-A2 LONG-ACTING GIPR ANTAGONISTS NOVO NORDISK A/S (DK) 2023-07-27 — — WO disclosed
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