SCHEMBL30435870

SCHEMBL30435870

CSCC[C@H](NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(N)=O)NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@H](Cc1ccccc1)NC(=O)CNC(=O)CN)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@@H](CCCNC(=N)N)C(=O)O)C(C)C)C(C)C

nearest known ligand 0.76

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 11/20 0.72
▸ GCGR P47871 8/20 0.72
▸ NMBR P28336 2/20 0.69
▸ GRPR P30550 2/20 0.69
▸ CTSL P07711 3/20 0.65
▸ CTSS P25774 3/20 0.65
▸ CTSK P43235 3/20 0.65
▸ CTSH P09668 1/20 0.65
▸ GIPR P48546 5/20 0.64
▸ C5AR1 P21730 1/20 0.63
▸ NPY1R P25929 1/20 0.63
▸ NPY2R P49146 1/20 0.63
▸ NPY4R P50391 1/20 0.63
▸ NPY5R Q15761 1/20 0.63

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
SCHEMBL31182680 0.92 GLP1R (0.74) GLP1RGCGRNMBRGRPRC5AR1
SCHEMBL29587969 0.90 GLP1R (0.73) GLP1RGCGRNMBRGRPRC5AR1
SCHEMBL30578647 0.90 GLP1R (0.73) GLP1RGCGRNMBRGRPRC5AR1
SCHEMBL30658250 0.90 GLP1R (0.69) GLP1RGCGRNMBRGRPRCTSL
SCHEMBL30932062 0.89 GLP1R (0.74) GLP1RGCGRNMBRGRPRGIPR
SCHEMBL30082666 0.89 GLP1R (0.73) GLP1RGCGRNMBRGRPRC5AR1
SCHEMBL29755703 0.89 GLP1R (0.72) GLP1RGCGRNMBRGRPRC5AR1
SCHEMBL30658295 0.89 GLP1R (0.69) GLP1RGCGRNMBRGRPRNPY1R
SCHEMBL31027142 0.89 GLP1R (0.75) GLP1RGCGRGIPRNPY1RNPY2R
SCHEMBL20764721 0.89 GRPR (0.70) GLP1RGCGRNMBRGRPRCTSL

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-20230167470-A1 METHOD AND STRAINS FOR REDUCING BYPRODUCT SUCCINIC ACID IN FERMENTATION PROCESS OF L-MALIC ACID AND USE THEREOF Nanjing Haohe Biotechnology Co., Ltd. (CN) 2023-06-01 — — US disclosed
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