SCHEMBL22552873

SCHEMBL22552873

CC(C)(C)OC(=O)NC1CC(OCC(NC(=O)OCc2ccccc2)C(=O)O)C1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 3/20 0.54
PPARG P37231 2/20 0.50
SYK P43405 1/20 0.49
KLK7 P49862 7/20 0.49
KLK5 Q9Y337 6/20 0.49
KMT2A Q03164 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.48
CTSS P25774 2/20 0.45
CTSK P43235 4/20 0.44
CTSL P07711 2/20 0.44
ITGB3 P05106 1/20 0.44
ITGA2B P08514 1/20 0.44
CTSB P07858 1/20 0.44
ACE P12821 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
SCHEMBL22552872 1.00 PPARA (0.54) PPARAPPARGSYKKLK7KLK5
SCHEMBL20825549 0.93 SYK (0.51) PPARASYKKLK7KLK5KMT2A
SCHEMBL22552775 0.93 SYK (0.51) PPARASYKKLK7KLK5KMT2A
SCHEMBL22552666 0.89 PPARA (0.51) PPARAPPARGSYKKLK7KLK5
SCHEMBL22552668 0.89 PPARA (0.51) PPARAPPARGSYKKLK7KLK5
SCHEMBL20825633 0.84 SYK (0.50) PPARAPPARGSYKKLK7KLK5
SCHEMBL22552766 0.84 MDM2 (0.48)
SCHEMBL22433327 0.84 MDM2 (0.48)
SCHEMBL22579992 0.84 MDM2 (0.48)
SCHEMBL3830180 0.83 KMT2A (0.60) PPARASYKKLK7KLK5KMT2A

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-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

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 PPARA 455/4885PPARG 1675/4885SYK 2886/4885
US-20230025834-A1 CYCLIC PEPTIDE ANTIBIOTICS NPPA, LNPEP, CLPP PPARA 455/4885PPARG 1675/4885SYK 2886/4885
US-11279735-B2 Cyclic peptide antibiotics NPPA, LNPEP, CLPP PPARA 455/4885PPARG 1675/4885SYK 2886/4885

“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.