SCHEMBL24965934

SCHEMBL24965934

CN(C(=O)C(C)(C)N(C)C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(=O)O)C(=O)N1CCCC1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 3/20 0.35
▸ PTPN1 P18031 1/20 0.35
▸ RRM1 P23921 1/20 0.34
▸ RRM2 P31350 1/20 0.34
▸ RRM2B Q7LG56 1/20 0.34
▸ FPR2 P25090 3/20 0.34
▸ REN P00797 1/20 0.33
▸ BACE1 P56817 1/20 0.33
▸ EED O75530 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
SCHEMBL24966013 0.91 CASP3 (0.39) CASP3PTPN1RRM1RRM2RRM2B
SCHEMBL24966009 0.91 CASP3 (0.39) CASP3PTPN1RRM1RRM2RRM2B
SCHEMBL22605955 0.90 FPR2 (0.39) CASP3RRM1RRM2RRM2BFPR2
SCHEMBL22605956 0.90 FPR2 (0.39) CASP3RRM1RRM2RRM2BFPR2
SCHEMBL29709595 0.89 CASP3 (0.41) CASP3PTPN1RRM1RRM2RRM2B
SCHEMBL24965940 0.88 CASP3 (0.38) CASP3BACE1
SCHEMBL24965939 0.88 CASP3 (0.38) CASP3BACE1
SCHEMBL24964996 0.84 PTPN1 (0.32) PTPN1REN
SCHEMBL30278725 0.82 OPRK1 (0.43) CASP3PTPN1FPR2
SCHEMBL30278723 0.82 OPRK1 (0.43) CASP3PTPN1FPR2

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-20230026641-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND COMPRISING HIGHLY STERICALLY HINDERED AMINO ACID CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-01-26 — — 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-20230026641-A1 METHOD FOR PRODUCING PEPTIDE COMPOUND COMPRISING HIGHLY STERICALLY HINDERED AMINO ACID DNPEP, VIP, NPEPPS CASP3 1864/4885PTPN1 2866/4885RRM1 3109/4885

“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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