SCHEMBL30163429

SCHEMBL30163429

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

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 7/20 0.56
▸ CASP3 P42574 3/20 0.49
▸ TLR2 O60603 2/20 0.46
▸ CTSB P07858 1/20 0.46
▸ CTSK P43235 1/20 0.46
▸ KMT2A Q03164 1/20 0.45
▸ MDM2 Q00987 1/20 0.44
▸ GRB2 P62993 1/20 0.44
▸ PSMB5 P28074 1/20 0.43

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
SCHEMBL29431036 0.95 CASP3 (0.53) PTPN1CASP3TLR2KMT2AMDM2
SCHEMBL30163210 0.91 PTPN1 (0.53) PTPN1CASP3TLR2CTSBCTSK
SCHEMBL30386840 0.91 PTPN1 (0.64) PTPN1CASP3TLR2KMT2AMDM2
SCHEMBL29462949 0.91 PTPN1 (0.64) PTPN1CASP3TLR2KMT2AMDM2
SCHEMBL31564904 0.88 PTPN1 (0.56) PTPN1CASP3TLR2CTSBCTSK
SCHEMBL29462951 0.88 CASP3 (0.49) PTPN1CASP3TLR2MDM2
SCHEMBL28359771 0.86 CASP3 (0.62) PTPN1CASP3TLR2KMT2AMDM2
SCHEMBL28359770 0.86 CASP3 (0.62) PTPN1CASP3TLR2KMT2AMDM2
SCHEMBL30968394 0.86 TLR2 (0.48) PTPN1CASP3TLR2KMT2AMDM2
SCHEMBL30945915 0.86 CTSB (0.51) PTPN1CASP3CTSBCTSK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240319146-A1 ANALYSIS METHOD FOR PEPTIDE BOUND TO CARRIER FOR LIQUID PHASE PEPTIDE SYNTHESIS PEPTISTAR INC. (JP) 2024-09-26 — — US disclosed
EP-4365184-A1 ANALYSIS METHOD FOR PEPTIDE BOUND TO CARRIER FOR LIQUID PHASE PEPTIDE SYNTHESIS Peptistar Inc. (JP) 2024-05-08 — — EP disclosed
WO-2023277186-A1 ANALYSIS METHOD FOR PEPTIDE BOUND TO CARRIER FOR LIQUID PHASE PEPTIDE SYNTHESIS ペプチスター株式会社 2023-01-05 — — WO 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-20240319146-A1 ANALYSIS METHOD FOR PEPTIDE BOUND TO CARRIER FOR LIQUID PHASE PEPTIDE SYNTHESIS HDGF, VIP, NPPA PTPN1 4090/4885CASP3 4685/4885TLR2 4291/4885

“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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