SCHEMBL30384901

SCHEMBL30384901

CC(C)(NC(=O)[C@H](Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)N[C@@H](CCC(=O)OCc1ccccc1)C(=O)NCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 8/20 0.48
▸ NMBR P28336 1/20 0.41
▸ MDM4 O15151 1/20 0.39
▸ TP53 P04637 1/20 0.39
▸ SIRT2 Q8IXJ6 3/20 0.37
▸ HDAC1 Q13547 1/20 0.37
▸ HDAC2 Q92769 1/20 0.37
▸ GRB2 P62993 1/20 0.37
▸ BCHE P06276 2/20 0.36
▸ ACHE P22303 2/20 0.36
▸ CACNA1F O60840 1/20 0.36
▸ CACNA1D Q01668 1/20 0.36
▸ CACNA1S Q13698 1/20 0.36
▸ CACNA1C Q13936 1/20 0.36

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
SCHEMBL30384822 0.88 PTPN1 (0.44) PTPN1NMBRMDM4TP53SIRT2
SCHEMBL29759585 0.87 NMBR (0.47) PTPN1NMBRMDM4TP53SIRT2
SCHEMBL29427171 0.85 NMBR (0.48) NMBRMDM4TP53SIRT2
SCHEMBL30185441 0.83 PTPN1 (0.41) PTPN1MDM4TP53GRB2
SCHEMBL30385679 0.83 MDM4 (0.49) NMBRMDM4TP53SIRT2
SCHEMBL30385359 0.83 PTPN1 (0.38) PTPN1NMBRMDM4TP53SIRT2
SCHEMBL29839944 0.82 NMBR (0.46) NMBRMDM4TP53SIRT2
SCHEMBL30250367 0.82 NMBR (0.42) NMBRSIRT2
SCHEMBL30641716 0.81 PTPN1 (0.40) PTPN1NMBRMDM4TP53SIRT2
SCHEMBL30385094 0.79 PTPN1 (0.59) PTPN1HDAC1HDAC2BCHEACHE

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-20230133716-A1 PREPARATION METHOD FOR SEMAGLUTIDE Shenzhen JYMed Technology Co., Ltd. (CN) 2023-05-04 — — 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-20230133716-A1 PREPARATION METHOD FOR SEMAGLUTIDE GCG, GLP1R, DPP7 PTPN1 2050/4885NMBR 3029/4885MDM4 3641/4885

“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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