SCHEMBL23056261

SCHEMBL23056261

CC(C)(C)OC(=O)N[C@@H](CCCC(=O)NCC(=O)OCc1ccccc1)C(=O)OCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KLK7 P49862 4/20 0.51
KLK5 Q9Y337 3/20 0.51
CTSK P43235 4/20 0.51
CTSS P25774 4/20 0.48
SYK P43405 1/20 0.48
PPARA Q07869 1/20 0.48
MAPT P10636 1/20 0.48
ACE P12821 1/20 0.47
ITGB3 P05106 1/20 0.47
ITGA2B P08514 1/20 0.47
BCHE P06276 1/20 0.47
ACHE P22303 1/20 0.47
CTSL P07711 1/20 0.47
CTSB P07858 1/20 0.47

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
SCHEMBL23156977 0.94 KLK7 (0.51) KLK7KLK5CTSKCTSSSYK
SCHEMBL15083131 0.94 KLK7 (0.51) KLK7KLK5CTSKCTSSSYK
SCHEMBL16288805 0.87 PPARA (0.55) KLK7KLK5CTSKCTSSSYK
SCHEMBL5970500 0.87 PPARA (0.52) KLK7KLK5CTSKCTSSSYK
SCHEMBL16574592 0.87 KLK5 (0.57) KLK7KLK5CTSKCTSSSYK
SCHEMBL10284237 0.86 CTSS (0.56) KLK7KLK5CTSKCTSSSYK
SCHEMBL14864738 0.86 CTSS (0.56) KLK7KLK5CTSKCTSSSYK
SCHEMBL3817109 0.86 PPARA (0.55) KLK7KLK5CTSKCTSSSYK
SCHEMBL1517760 0.86 PPARA (0.55) KLK7KLK5CTSKCTSSSYK
SCHEMBL8322873 0.85 KLK5 (0.53) KLK7KLK5CTSKCTSSSYK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210061860-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2021-03-04 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 (1 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-20210061860-A1 PEPTIDE-COMPOUND CYCLIZATION METHOD VIP, NGLY1, GLP1R KLK7 326/4885KLK5 403/4885CTSK 188/4885

“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.