SCHEMBL20825486

SCHEMBL20825486

COC(=O)[C@H](CO[C@H]1CC[C@@H](NC(=O)OC(C)(C)C)CC1)NC(=O)OCC1c2ccccc2-c2ccccc21

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MDM2 Q00987 1/20 0.42
MDM4 O15151 2/20 0.41
TP53 P04637 2/20 0.41
NFKB1 P19838 1/20 0.39
NFKB2 Q00653 1/20 0.39
RELA Q04206 1/20 0.39
CASP3 P42574 1/20 0.39
KDM1A O60341 1/20 0.39
MAOB P27338 1/20 0.39
BACE1 P56817 1/20 0.39
TNF P01375 1/20 0.39
TLR2 O60603 1/20 0.39

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
SCHEMBL20825490 1.00 MDM2 (0.42) MDM2MDM4TP53NFKB1NFKB2
SCHEMBL20825773 0.93 MDM2 (0.48) MDM2MDM4TP53CASP3TNF
SCHEMBL29635950 0.89 MDM2 (0.41) MDM2MDM4TP53NFKB1NFKB2
SCHEMBL24633710 0.89 MDM4 (0.47) MDM4TP53CASP3TNFTLR2
SCHEMBL25260682 0.89 MDM4 (0.47) MDM4TP53CASP3TNFTLR2
SCHEMBL25260680 0.89 MDM4 (0.47) MDM4TP53CASP3TNFTLR2
SCHEMBL25657544 0.85 MDM4 (0.46) MDM4TP53CASP3TNFTLR2
SCHEMBL22579992 0.85 MDM2 (0.48) MDM2MDM4TP53CASP3TNF
SCHEMBL22433327 0.85 MDM2 (0.48) MDM2MDM4TP53CASP3TNF
SCHEMBL22552766 0.85 MDM2 (0.48) MDM2MDM4TP53CASP3TNF

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-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
WO-2019052545-A1 CYCLIC PEPTIDE ANTIBIOTICS F. HOFFMANN-LA ROCHE AG (CH) 2019-03-21 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 MDM2 2362/4885MDM4 3536/4885TP53 2216/4885
US-11279735-B2 Cyclic peptide antibiotics NPPA, LNPEP, CLPP MDM2 2362/4885MDM4 3536/4885TP53 2216/4885

“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.