SCHEMBL30782930

SCHEMBL30782930

CC(C)(C)OC[C@H](NC(=O)CNC(=O)[C@H](CC(=O)OC(C)(C)C)NC(=O)CNC(=O)[C@H](Cc1cn(C(c2ccccc2)(c2ccccc2)c2ccccc2)cn1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc1ccccc1)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](CCC(=O)O)C(=O)O

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ ACE P12821 1/20 0.40
▸ CTSS P25774 2/20 0.40
▸ CTSL P07711 1/20 0.40
▸ CTSB P07858 1/20 0.40
▸ CTSK P43235 1/20 0.40
▸ PTPN1 P18031 1/20 0.39
▸ SIRT2 Q8IXJ6 1/20 0.38
▸ CCKBR P32239 11/20 0.38
▸ AMY2A P04746 8/20 0.38
▸ AKT1 P31749 1/20 0.38
▸ CCKAR P32238 3/20 0.38
▸ OPRD1 P41143 3/20 0.38

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
SCHEMBL31414641 0.87 NMBR (0.46) ACECTSSCTSLCTSBCTSK
SCHEMBL34461946 0.86 REN (0.39) CCKBRCCKAROPRD1
SCHEMBL34461945 0.86 REN (0.40) CCKBRCCKAROPRD1
SCHEMBL30343346 0.85 PSEN1 (0.36) OPRD1
SCHEMBL30437059 0.84 REN (0.39) CCKBRCCKAROPRD1
SCHEMBL30524338 0.84 PSEN1 (0.38) OPRD1
SCHEMBL30665993 0.83 NMBR (0.44) CTSSCTSLCTSBCTSKSIRT2
SCHEMBL30250211 0.83 OPRD1 (0.36) CCKBRCCKAROPRD1
SCHEMBL31094168 0.83 REN (0.38) ACECTSSCTSLCTSBCTSK
SCHEMBL30065645 0.83 SIRT2 (0.40) ACESIRT2

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-20240067694-A1 SYNTHESIS OF TEDUGLUTIDE BIOCON LIMITED (IN) 2024-02-29 — — 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-20240067694-A1 SYNTHESIS OF TEDUGLUTIDE DNPEP, GCLC, PTMS ACE 533/4885CTSS 196/4885CTSL 35/4885

“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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