SCHEMBL30035925

SCHEMBL30035925

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)CNC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CASP3 P42574 4/20 0.43
▸ OPRD1 P41143 1/20 0.40
▸ KMT2A Q03164 1/20 0.39
▸ TNF P01375 1/20 0.38
▸ PTPN1 P18031 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
SCHEMBL30036724 0.90 CASP3 (0.42) CASP3TNFPTPN1
SCHEMBL22605953 0.89 OPRD1 (0.41) CASP3OPRD1KMT2APTPN1
SCHEMBL22605954 0.89 OPRD1 (0.41) CASP3OPRD1KMT2APTPN1
SCHEMBL30036912 0.85 CASP3 (0.42) CASP3TNFPTPN1
SCHEMBL30034829 0.84 CASP3 (0.41) CASP3TNFPTPN1
SCHEMBL29696715 0.81 CASP3 (0.48) CASP3KMT2ATNF
SCHEMBL29696671 0.80 CASP3 (0.51) CASP3KMT2ATNF
SCHEMBL29696650 0.80 KMT2A (0.51) CASP3OPRD1KMT2A
SCHEMBL22605622 0.79 CASP3 (0.36) CASP3PTPN1
SCHEMBL29709487 0.79 CASP3 (0.46) CASP3KMT2ATNFPTPN1

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 3776/4885OPRD1 4378/4885KMT2A 2894/4885

“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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