SCHEMBL29796964

SCHEMBL29796964

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

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 9/20 0.55
▸ F2 P00734 4/20 0.54
▸ CALCR P30988 4/20 0.53
▸ PTH1R Q03431 2/20 0.52
▸ CRHR1 P34998 1/20 0.51
▸ CRHR2 Q13324 1/20 0.51

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
SCHEMBL29797050 0.98 GLP1R (0.53) GLP1RF2CALCRPTH1RCRHR1
SCHEMBL29794317 0.96 GLP1R (0.59) GLP1RPTH1R
SCHEMBL30544875 0.96 GLP1R (0.59) GLP1RPTH1R
SCHEMBL29797102 0.95 GLP1R (0.58) GLP1RPTH1R
SCHEMBL30524358 0.92 GLP1R (0.62) GLP1RCALCRCRHR1CRHR2
SCHEMBL30262228 0.92 GLP1R (0.56) GLP1RPTH1R
SCHEMBL30720019 0.92 GLP1R (0.47) GLP1RF2CALCR
SCHEMBL29625325 0.92 CALCR (0.55) GLP1RF2CALCRCRHR1CRHR2
SCHEMBL31303964 0.90 PTH1R (0.59) GLP1RF2CALCRPTH1RCRHR1
SCHEMBL30165219 0.90 GRIN2D (0.45) GLP1RF2CALCRPTH1RCRHR1

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-114786704-A Active polypeptide compounds 陕西麦科奥特科技有限公司 2022-07-22 — — CN claimed
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