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Sugi Predict / Compounds / SCHEMBL29722072

SCHEMBL29722072

SCHEMBL29722072

CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)C(C)(C)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@H](Cc1ccc(O)cc1)NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@@H](N)Cc1ccc(O)cc1)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 16/20 0.65
▸ OPRM1 P35372 4/20 0.64
▸ OPRD1 P41143 4/20 0.64
▸ OPRK1 P41145 4/20 0.64
▸ GCGR P47871 1/20 0.63
▸ GIPR P48546 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
SCHEMBL31062669 1.00 GLP1R (0.65) GLP1ROPRM1OPRD1OPRK1GCGR
SCHEMBL30852826 0.97 GLP1R (0.64) GLP1ROPRM1OPRD1OPRK1GCGR
SCHEMBL30852846 0.97 GLP1R (0.64) GLP1ROPRM1OPRD1OPRK1GCGR
SCHEMBL31312694 0.97 OPRM1 (0.65) GLP1ROPRM1OPRD1OPRK1GCGR
SCHEMBL30080556 0.96 OPRM1 (0.61) GLP1ROPRM1OPRD1OPRK1GCGR
SCHEMBL31467321 0.95 OPRM1 (0.62) GLP1ROPRM1OPRD1OPRK1GCGR
SCHEMBL30071477 0.95 GLP1R (0.70) GLP1R
SCHEMBL30407652 0.94 OPRM1 (0.64) GLP1ROPRM1OPRD1OPRK1
SCHEMBL30406777 0.94 OPRM1 (0.63) GLP1ROPRM1OPRD1OPRK1GCGR
SCHEMBL30408253 0.92 OPRM1 (0.62) GLP1ROPRM1OPRD1OPRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118685386-B Protease variant and application thereof 深圳佳肽生物科技有限公司 2024-12-06 — — CN disclosed
CN-114736271-B Tirzepatide synthesis method 江苏诺泰澳赛诺生物制药股份有限公司 2024-10-29 — — CN disclosed
CN-118685386-A Protease variant and application thereof 深圳佳肽生物科技有限公司 2024-09-24 — — CN disclosed
CN-118666988-A Composition for synthesis Trizepatide and synthetic method of Trizepatide 深圳佳肽生物科技有限公司 2024-09-20 — — CN disclosed
CN-117946243-A Preparation method of Tirzepatide 江苏诺泰澳赛诺生物制药股份有限公司 2024-04-30 — — CN disclosed
CN-115651075-B Synthesis method of Tirzepatide 杭州信海医药科技有限公司 2023-04-11 — — CN disclosed
CN-115677827-A Peptide compounds 深圳市健元医药科技有限公司 2023-02-03 — — CN disclosed
CN-115651075-A Synthesis method of Tirzepatide 杭州信海医药科技有限公司 2023-01-31 — — CN disclosed
CN-114736271-A Synthesis method of Tirzepatide 杭州诺泰澳赛诺医药技术开发有限公司 2022-07-12 — — CN disclosed
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