SCHEMBL30278705

SCHEMBL30278705

CNC(=O)CC[C@H](NC(=O)OCC1c2ccccc2-c2ccccc21)C(=O)OC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TLR2 O60603 2/20 0.49
▸ MDM4 O15151 2/20 0.48
▸ TP53 P04637 2/20 0.48
▸ MDM2 Q00987 1/20 0.47
▸ KMT2A Q03164 1/20 0.46
▸ CASP3 P42574 1/20 0.44

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
SCHEMBL29540049 1.00 TLR2 (0.49) TLR2MDM4TP53MDM2KMT2A
SCHEMBL21837757 1.00 TLR2 (0.49) TLR2MDM4TP53MDM2KMT2A
SCHEMBL15083101 1.00 TLR2 (0.49) TLR2MDM4TP53MDM2KMT2A
SCHEMBL18291541 0.92 MDM2 (0.45) TLR2MDM4TP53MDM2KMT2A
SCHEMBL23447188 0.90 TLR2 (0.56) TLR2MDM4TP53MDM2KMT2A
SCHEMBL20732316 0.90 PTPN1 (0.49) TLR2MDM4TP53MDM2KMT2A
SCHEMBL20732318 0.90 PTPN1 (0.49) TLR2MDM4TP53MDM2KMT2A
SCHEMBL22069879 0.90 PTPN1 (0.49) TLR2MDM4TP53MDM2KMT2A
SCHEMBL31133584 0.90 PTPN1 (0.49) TLR2MDM4TP53MDM2KMT2A
SCHEMBL22069859 0.90 PTPN1 (0.49) TLR2MDM4TP53MDM2KMT2A

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-20230096766-A1 AMINO ACID HAVING FUNCTIONAL GROUP CAPABLE OF INTERMOLECULAR HYDROGEN BONDING, PEPTIDE COMPOUND CONTAINING SAME AND METHOD FOR PRODUCTION THEREOF CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2023-03-30 — — 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-20230096766-A1 AMINO ACID HAVING FUNCTIONAL GROUP CAPABLE OF INTERMOLECULAR HYDROGEN BONDING, PEPTIDE COMPOUND CONTAINING SAME AND METHOD FOR PRODUCTION THEREOF VIP, DNPEP, HM13 TLR2 3912/4885MDM4 3098/4885TP53 3050/4885

“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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