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SCHEMBL30139565

SCHEMBL30139565

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

nearest known ligand 0.72

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GLP1R P43220 9/20 0.72
▸ TFPI P10646 1/20 0.64
▸ OPRM1 P35372 2/20 0.59
▸ OPRD1 P41143 2/20 0.59
▸ OPRK1 P41145 2/20 0.59
▸ SCTR P47872 1/20 0.58
▸ GCGR P47871 1/20 0.56
▸ GIPR P48546 1/20 0.56

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
SCHEMBL31265496 0.94 GLP1R (0.66) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL29373682 0.93 TFPI (0.68) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL30721553 0.93 TFPI (0.66) GLP1RTFPI
SCHEMBL30836920 0.93 TFPI (0.66) GLP1RTFPISCTRGCGRGIPR
SCHEMBL30721551 0.93 GLP1R (0.70) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL30721572 0.92 GLP1R (0.61) GLP1RTFPIOPRM1OPRD1OPRK1
SCHEMBL30271991 0.92 TFPI (0.66) GLP1RTFPI
SCHEMBL30120636 0.92 TFPI (0.66) GLP1RTFPI
SCHEMBL30721600 0.92 TFPI (0.64) GLP1RTFPIGCGRGIPR
SCHEMBL30271990 0.91 TFPI (0.67) GLP1RTFPI

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4146249-A1 IMPROVED PROCESS FOR THE PREPARATION OF SEMAGLUTIDE Neuland Laboratories Ltd (IN) 2023-03-15 — — EP claimed
CN-113429471-B Long-acting GLP-1 polypeptide analogue, and preparation method and application thereof 青岛博睿精创科技有限公司 2022-12-23 — — CN claimed
CN-116120427-B Semex lattice Synthesis method of lupeptide 浙江九洲药业股份有限公司 2024-12-10 — — CN disclosed
WO-2024159569-A1 METHOD FOR SYNTHESIZING SEMAGLUTIDE 浙江九洲药业股份有限公司 2024-08-08 — — WO disclosed
CN-116120427-A Synthesis method of semaglutin 浙江九洲药业股份有限公司 2023-05-16 — — CN disclosed
CN-110078816-B Preparation method of somalupeptide 扬子江药业集团四川海蓉药业有限公司 2023-04-25 — — CN disclosed
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