SCHEMBL31094178

SCHEMBL31094178

CC(C)C[C@H](NC(=O)[C@@H](N)Cc1ccc(OC(C)(C)C)cc1)C(=O)N[C@@H](CC(=O)OC(C)(C)C)C(=O)N[C@@H](CO)C(=O)O

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CTSL P07711 1/20 0.46
▸ CTSK P43235 1/20 0.46
▸ MMP1 P03956 2/20 0.45
▸ ABCB1 P08183 1/20 0.45
▸ PSMB5 P28074 1/20 0.43
▸ NPY1R P25929 1/20 0.42
▸ NPY2R P49146 1/20 0.42
▸ NPY4R P50391 1/20 0.42
▸ REN P00797 3/20 0.42
▸ KISS1R Q969F8 4/20 0.41
▸ LTA4H P09960 1/20 0.41
▸ ACACB O00763 1/20 0.40
▸ OPRM1 P35372 1/20 0.40
▸ OPRD1 P41143 1/20 0.40

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
SCHEMBL31510099 0.87 CTSL (0.47) CTSLCTSKMMP1ABCB1NPY1R
SCHEMBL29666997 0.86 LTA4H (0.54) CTSLCTSKNPY1RNPY2RNPY4R
SCHEMBL30863579 0.81 CTSL (0.48) CTSLCTSKNPY1RNPY2RNPY4R
SCHEMBL30277524 0.80 CTSL (0.44) CTSLCTSKMMP1NPY1RNPY2R
SCHEMBL30483692 0.80 MMP1 (0.47) CTSLCTSKMMP1ABCB1NPY1R
SCHEMBL31347321 0.80 OPRK1 (0.41) NPY1RNPY2RNPY4RRENOPRM1
SCHEMBL31510075 0.79 NPY4R (0.46) CTSLCTSKMMP1ABCB1NPY1R
SCHEMBL30647289 0.79 ABCB1 (0.43) CTSLCTSKMMP1ABCB1REN
SCHEMBL30658624 0.79 CTSL (0.55) CTSLCTSKMMP1NPY1RNPY2R
SCHEMBL31614459 0.78 OPRD1 (0.44) CTSLCTSKNPY1RNPY2RNPY4R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4655312-A1 A PROCESS FOR THE PREPARATION OF GLUCAGON Biocon Limited (IN) 2025-12-03 — — EP disclosed
CN-119039418-A Preparation method of Tirzepatide 江苏慧聚药业股份有限公司 2024-11-29 — — CN disclosed
WO-2024157198-A1 A PROCESS FOR THE PREPARATION OF GLUCAGON BIOCON LIMITED (IN) 2024-08-02 — — WO disclosed
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