SCHEMBL30512529

SCHEMBL30512529

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

nearest known ligand 0.49

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 15/20 0.48
▸ SCTR P47872 1/20 0.47
▸ CALCR P30988 2/20 0.46
▸ TFPI P10646 1/20 0.46
▸ CRHR1 P34998 1/20 0.46
▸ CRHR2 Q13324 1/20 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
SCHEMBL30974612 0.90 BACE1 (0.51) GLP1RSCTR
SCHEMBL31410851 0.90 EGFR (0.50) GLP1R
SCHEMBL30576976 0.90 GLP1R (0.56) GLP1RCALCRCRHR1CRHR2
SCHEMBL30974323 0.89 BACE1 (0.47) GLP1RSCTR
SCHEMBL30974246 0.89 BACE1 (0.47) GLP1RSCTR
SCHEMBL30209778 0.89 BACE1 (0.56) GLP1RSCTRCALCRTFPI
SCHEMBL30974400 0.88 GLP1R (0.49) GLP1RSCTR
SCHEMBL30436887 0.88 CALCR (0.55) GLP1RSCTRCALCRCRHR1CRHR2
SCHEMBL31182851 0.87 F2 (0.51) GLP1RSCTRCALCRTFPICRHR1
SCHEMBL29384813 0.87 GLP1R (0.49) GLP1RSCTRCALCRCRHR1CRHR2

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
CN-116490215-A Targeted mediated endocytic drug delivery CRM医疗有限公司 2023-07-25 — — CN disclosed
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