SCHEMBL30036724

SCHEMBL30036724

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

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.42
▸ MME P08473 2/20 0.40
▸ RRM1 P23921 1/20 0.39
▸ RRM2 P31350 1/20 0.39
▸ RRM2B Q7LG56 1/20 0.39
▸ TNF P01375 1/20 0.37
▸ PTPN1 P18031 2/20 0.36
▸ ECE1 P42892 1/20 0.36
▸ MDM4 O15151 1/20 0.36
▸ TP53 P04637 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
SCHEMBL30035925 0.90 CASP3 (0.43) CASP3TNFPTPN1
SCHEMBL29709487 0.90 CASP3 (0.46) CASP3MMERRM1RRM2RRM2B
SCHEMBL29696715 0.90 CASP3 (0.48) CASP3TNFMDM4TP53
SCHEMBL22605622 0.89 CASP3 (0.36) CASP3RRM1RRM2RRM2BPTPN1
SCHEMBL29860758 0.86 MME (0.46) CASP3MMEECE1
SCHEMBL30036912 0.86 CASP3 (0.42) CASP3TNFPTPN1MDM4TP53
SCHEMBL30036228 0.85 ACE (0.40) —
SCHEMBL30034829 0.85 CASP3 (0.41) CASP3TNFPTPN1MDM4TP53
SCHEMBL24579736 0.84 CASP3 (0.45) CASP3PTPN1MDM4TP53
SCHEMBL24579184 0.84 CASP3 (0.45) CASP3PTPN1MDM4TP53

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111479819-B Method for preparing peptide and method for treating alkali 中外制药株式会社 2024-06-14 — — CN disclosed
US-11492369-B2 Method for producing peptide, and method for processing bases CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2022-11-08 — — 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-11492369-B2 Method for producing peptide, and method for processing bases VIP, NPPA, PTMS CASP3 3776/4885MME 73/4885RRM1 1107/4885

“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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