SCHEMBL30165272

SCHEMBL30165272

CC[C@H](C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)CCN)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)NCCC(=O)O)C(C)C

nearest known ligand 0.49

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 12/20 0.49
▸ CALCR P30988 4/20 0.47
▸ CRHR1 P34998 1/20 0.46
▸ CRHR2 Q13324 1/20 0.46
▸ GRIN2D O15399 1/20 0.46
▸ GRIN3B O60391 1/20 0.46
▸ GRIN1 Q05586 1/20 0.46
▸ GRIN2A Q12879 1/20 0.46
▸ GRIN2B Q13224 1/20 0.46
▸ GRIN2C Q14957 1/20 0.46
▸ GRIN3A Q8TCU5 1/20 0.46
▸ F2 P00734 1/20 0.46
▸ KEAP1 Q14145 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
SCHEMBL30165190 0.97 GLP1R (0.48) GLP1RCALCRF2
SCHEMBL30165148 0.94 GRIN2D (0.48) GLP1RCALCRCRHR1CRHR2GRIN2D
SCHEMBL30165255 0.94 GRIN2D (0.48) GLP1RCALCRCRHR1CRHR2GRIN2D
SCHEMBL30165162 0.92 CTSD (0.46) GLP1RCALCRCRHR1CRHR2GRIN2D
SCHEMBL30165147 0.92 F2 (0.48) GLP1RGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30165207 0.92 F2 (0.48) GLP1RGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL30165209 0.92 GRIN2D (0.48) GLP1RCALCRCRHR1CRHR2GRIN2D
SCHEMBL30165181 0.92 BACE1 (0.50) GLP1RCALCR
SCHEMBL30165145 0.91 GLP1R (0.50) GLP1RCALCRCRHR1CRHR2
SCHEMBL30165174 0.91 GLP1R (0.50) GLP1RCALCRCRHR1CRHR2

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-2023006083-A1 NEUROPROTECTIVE POLYPEPTIDE COMPOUND AND APPLICATION THEREOF 英纳氏(珠海)药业有限公司 2023-02-02 — — WO disclosed
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