SCHEMBL30437952

SCHEMBL30437952

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

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 5/20 0.40
▸ OPRD1 P41143 6/20 0.38
▸ CCKAR P32238 5/20 0.38
▸ CCKBR P32239 5/20 0.38
▸ BACE1 P56817 3/20 0.37

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
SCHEMBL30438040 0.94 GLP1R (0.38) RENOPRD1
SCHEMBL30437059 0.92 REN (0.39) RENOPRD1CCKARCCKBRBACE1
SCHEMBL34461945 0.89 REN (0.40) RENOPRD1CCKARCCKBRBACE1
SCHEMBL31088668 0.89 REN (0.36) RENOPRD1CCKARCCKBR
SCHEMBL30836804 0.88 REN (0.42) RENOPRD1CCKARCCKBR
SCHEMBL30096878 0.88 REN (0.37) RENOPRD1CCKARCCKBR
SCHEMBL34461946 0.87 REN (0.39) RENOPRD1CCKARCCKBR
SCHEMBL29555524 0.87 OPRD1 (0.41) RENOPRD1CCKARCCKBR
SCHEMBL30437554 0.86 PSEN1 (0.37) RENOPRD1
SCHEMBL29554598 0.86 REN (0.37) RENOPRD1CCKARCCKBR

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-20230220036-A1 IMPROVED PROCESS FOR THE PREPARATION OF SEMAGLUTIDE NEULAND LABORATORIES LTD (IN) 2023-07-13 — — 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-20230220036-A1 IMPROVED PROCESS FOR THE PREPARATION OF SEMAGLUTIDE GCG, OGDH, ABAT REN 1559/4885OPRD1 1080/4885CCKAR 479/4885

“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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