SCHEMBL30647289

SCHEMBL30647289

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

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ ABCB1 P08183 1/20 0.43
▸ MMP1 P03956 3/20 0.40
▸ ITGB3 P05106 1/20 0.37
▸ ITGA2B P08514 1/20 0.37
▸ REN P00797 8/20 0.36
▸ ACACB O00763 1/20 0.34
▸ CTSL P07711 1/20 0.34
▸ CTSK P43235 1/20 0.34
▸ PRSS1 P07477 2/20 0.33
▸ TMPRSS15 P98073 1/20 0.33
▸ BCL2 P10415 1/20 0.33
▸ PLG P00747 1/20 0.33
▸ PRSS2 P07478 1/20 0.33
▸ PRSS3 P35030 1/20 0.33

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
SCHEMBL29468876 0.89 CTSD (0.41) ABCB1MMP1
SCHEMBL30250305 0.86 CTSD (0.44) REN
SCHEMBL30422766 0.85 CTSD (0.42) ABCB1MMP1REN
SCHEMBL30250381 0.83 CTSD (0.42) RENCTSLCTSK
SCHEMBL30250304 0.82 FNTA (0.39) CTSK
SCHEMBL26578688 0.82 GRN (0.36) —
SCHEMBL30541988 0.80 CASP3 (0.43) REN
SCHEMBL31518742 0.80 PSEN1 (0.42) RENCTSK
SCHEMBL29468879 0.79 ABCB1 (0.41) ABCB1MMP1
SCHEMBL31094178 0.79 CTSL (0.46) ABCB1MMP1RENACACBCTSL

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-20230364194-A1 GLP-1R/GCGR Dual Target Agonist Polypeptide Derivative for Treatment of Hepatic Fibrosis Associated with Viral Hepatitis SHENZHEN TURIER BIOTECH CO., LTD. (CN) 2023-11-16 — — US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230364194-A1 GLP-1R/GCGR Dual Target Agonist Polypeptide Derivative for Treatment of Hepatic Fibrosis Associated with Viral Hepatitis GLP1R, GCGR, GIPR ABCB1 1633/4885MMP1 604/4885ITGB3 3644/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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