SCHEMBL30801072

SCHEMBL30801072

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

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 17/20 0.71
▸ GCGR P47871 7/20 0.71
▸ NPY1R P25929 1/20 0.70
▸ NPY2R P49146 1/20 0.70
▸ NPY4R P50391 1/20 0.70
▸ NPY5R Q15761 1/20 0.70
▸ C5AR1 P21730 1/20 0.70
▸ CCKBR P32239 2/20 0.68
▸ GIPR P48546 4/20 0.66

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
SCHEMBL30403572 0.95 GLP1R (0.73) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL29429581 0.95 NPY1R (0.74) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL29429583 0.95 NPY1R (0.74) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL29367539 0.93 GLP1R (0.80) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL29367233 0.93 GLP1R (0.80) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL31182679 0.93 GLP1R (0.72) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL29638062 0.93 GLP1R (0.74) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL29638067 0.93 GLP1R (0.74) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL30307619 0.93 GLP1R (0.80) GLP1RGCGRNPY1RNPY2RNPY4R
SCHEMBL30307616 0.93 GLP1R (0.80) GLP1RGCGRNPY1RNPY2RNPY4R

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117866046-B Chemotherapy drug sensitization polypeptide and application thereof 广州杰尔克生物技术有限公司 2024-11-26 — — CN disclosed
CN-117866046-A Chemotherapy drug sensitization polypeptide and application thereof 广州杰尔克生物技术有限公司 2024-04-12 — — CN disclosed
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