SCHEMBL22552920

SCHEMBL22552920

C[C@H](OCCCNC(=O)OCc1ccccc1)[C@H](NC(=O)OC(C)(C)C)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.59
SYK P43405 1/20 0.50
L3MBTL1 Q9Y468 3/20 0.49
KLK7 P49862 2/20 0.49
KLK5 Q9Y337 2/20 0.49
HTT P42858 1/20 0.48
LMNA P02545 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
MEN1 O00255 1/20 0.46
RECQL P46063 1/20 0.46
KMT2A Q03164 1/20 0.46
POLB P06746 1/20 0.45
MAPK1 P28482 1/20 0.45
FOLH1 Q04609 1/20 0.45
PPARA Q07869 1/20 0.45
ITGB3 P05106 1/20 0.45
ITGA2B P08514 1/20 0.45
IDO1 P14902 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
SCHEMBL22552921 1.00 MAPT (0.59) MAPTSYKL3MBTL1KLK7KLK5
SCHEMBL20825476 0.94 MAPT (0.59) MAPTSYKL3MBTL1KLK7KLK5
SCHEMBL22552451 0.94 MAPT (0.59) MAPTSYKL3MBTL1KLK7KLK5
SCHEMBL20825469 0.87 MAPT (0.52) MAPTSYKL3MBTL1KLK7KLK5
SCHEMBL400186 0.83 PPARA (0.55) SYKMEN1KMT2APPARA
SCHEMBL1414711 0.83 PPARA (0.55) SYKMEN1KMT2APPARA
SCHEMBL12018371 0.83 PPARA (0.55) SYKMEN1KMT2APPARA
SCHEMBL3449019 0.83 PPARA (0.55) SYKMEN1KMT2APPARA
SCHEMBL2212074 0.83 PPARA (0.55) SYKMEN1KMT2APPARA
SCHEMBL400187 0.83 PPARA (0.55) SYKMEN1KMT2APPARA

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 2 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

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 MAPT 4597/4885SYK 2886/4885L3MBTL1 650/4885
US-11279735-B2 Cyclic peptide antibiotics NPPA, LNPEP, CLPP MAPT 4597/4885SYK 2886/4885L3MBTL1 650/4885

“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.