SCHEMBL20825549

SCHEMBL20825549

COC(=O)[C@H](CO[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)NC(=O)OCc1ccccc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.51
KLK7 P49862 6/20 0.50
KLK5 Q9Y337 5/20 0.50
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
KYNU Q16719 1/20 0.46
PPARA Q07869 1/20 0.46
CTSK P43235 7/20 0.46
ALDH1A1 P00352 2/20 0.45
CYP3A4 P08684 1/20 0.45
TSHR P16473 1/20 0.45
ALOX15 P16050 1/20 0.44
CTSL P07711 2/20 0.44
CTSS P25774 2/20 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
SCHEMBL22552775 1.00 SYK (0.51) SYKKLK7KLK5KMT2AL3MBTL1
SCHEMBL22552872 0.93 PPARA (0.54) SYKKLK7KLK5KMT2AL3MBTL1
SCHEMBL22552873 0.93 PPARA (0.54) SYKKLK7KLK5KMT2AL3MBTL1
SCHEMBL20825633 0.91 SYK (0.50) SYKKLK7KLK5KMT2AL3MBTL1
SCHEMBL22580196 0.89 SYK (0.48) SYKKLK7KLK5KMT2AKYNU
SCHEMBL20825644 0.89 SYK (0.48) SYKKLK7KLK5KMT2AKYNU
SCHEMBL20158205 0.82 YAP1 (0.49) SYKKLK7KLK5KYNUCTSK
SCHEMBL28743990 0.82 YAP1 (0.49) SYKKLK7KLK5KYNUCTSK
SCHEMBL22552666 0.82 PPARA (0.51) SYKKLK7KLK5KMT2APPARA
SCHEMBL22552668 0.82 PPARA (0.51) SYKKLK7KLK5KMT2APPARA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230025834-A1 CYCLIC PEPTIDE ANTIBIOTICS GENENTECH, INC. (US) 2023-01-26 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
WO-2020185999-A1 CYCLIC PEPTIDE ANTIBIOTICS GENENTECH, INC. (US) 2020-09-17 WO 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 (3 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 SYK 2886/4885KLK7 1229/4885KLK5 785/4885
US-20230025834-A1 CYCLIC PEPTIDE ANTIBIOTICS NPPA, LNPEP, CLPP SYK 2886/4885KLK7 1229/4885KLK5 785/4885
US-11279735-B2 Cyclic peptide antibiotics NPPA, LNPEP, CLPP SYK 2886/4885KLK7 1229/4885KLK5 785/4885

“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.