SCHEMBL3779667

SCHEMBL3779667

O=C(N[C@@H](Cc1cn(Cc2ccccc2)nn1)C(=O)O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MDM4 O15151 3/20 0.64
TP53 P04637 3/20 0.64
MDM2 Q00987 7/20 0.56
CASP3 P42574 2/20 0.43
SLC17A5 Q9NRA2 1/20 0.42
HDAC1 Q13547 1/20 0.42
HDAC2 Q92769 1/20 0.42

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
SCHEMBL13284070 1.00 MDM4 (0.64) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL13284068 0.93 MDM2 (0.62) MDM4TP53MDM2CASP3HDAC1
SCHEMBL3778309 0.93 MDM2 (0.62) MDM4TP53MDM2CASP3HDAC1
SCHEMBL3788273 0.90 MDM2 (0.57) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL13284069 0.88 MDM4 (0.62) MDM4TP53MDM2CASP3SLC17A5
SCHEMBL13285396 0.85 MDM4 (0.61) MDM4TP53MDM2CASP3
SCHEMBL3722114 0.85 MDM4 (0.63) MDM4TP53MDM2CASP3
SCHEMBL3722116 0.85 MDM4 (0.63) MDM4TP53MDM2CASP3
SCHEMBL31386689 0.84 MDM2 (0.54) MDM4TP53MDM2
SCHEMBL5717688 0.83 MDM4 (0.54) MDM4TP53MDM2CASP3HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3681875-B1 CYCLIC PEPTIDE ANTIBIOTICS HOFFMANN LA ROCHE (CH) 2026-01-14 EP disclosed
CN-111148739-B Cyclic peptide antibiotics 豪夫迈·罗氏有限公司 2025-06-03 CN disclosed
US-11279735-B2 Cyclic peptide antibiotics GENENTECH, INC. (US) 2022-03-22 US disclosed
US-11279735-B2 Cyclic peptide antibiotics GENENTECH, INC. (US) 2022-03-22 US disclosed
US-20200331968-A1 CYCLIC PEPTIDE ANTIBIOTICS GENENTECH, INC. (US) 2020-10-22 US disclosed
US-20200331968-A1 CYCLIC PEPTIDE ANTIBIOTICS GENENTECH, INC. (US) 2020-10-22 US disclosed
CN-111148739-A Cyclopeptide antibiotics 豪夫迈·罗氏有限公司 2020-05-12 CN disclosed
WO-2019052545-A1 CYCLIC PEPTIDE ANTIBIOTICS F. HOFFMANN-LA ROCHE AG (CH) 2019-03-21 WO disclosed
EP-2210882-A1 Synthesis of new protected azahistidine, their processes and their use in synthesises Commissariat à l'Énergie Atomique et aux Énergies Alternatives (FR) 2010-07-28 EP disclosed
WO-2010081882-A2 SYNTHESIS OF NEW PROTECTED AZAHISTIDINES, THEIR PROCESSES AND THEIR USE IN SYNTHESISES COMMISSARIAT A L'ENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES (FR) 2010-07-22 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 (2 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-20200331968-A1 CYCLIC PEPTIDE ANTIBIOTICS NPPA, LNPEP, CLPP MDM4 3536/4885TP53 2216/4885MDM2 2362/4885
US-11279735-B2 Cyclic peptide antibiotics NPPA, LNPEP, CLPP MDM4 3536/4885TP53 2216/4885MDM2 2362/4885

“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.