SCHEMBL24178265

SCHEMBL24178265

CSCC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H](C=O)Cc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GNPAT O15228 1/20 0.52
PTPN1 P18031 1/20 0.51
LTA4H P09960 1/20 0.49
CTSS P25774 1/20 0.49
CTSK P43235 1/20 0.49
ANPEP P15144 2/20 0.48
MME P08473 1/20 0.48
BACE1 P56817 1/20 0.47
CTSB P07858 2/20 0.47
CTSL P07711 1/20 0.47
PAM P19021 1/20 0.46
FNTA P49354 1/20 0.46
FNTB P49356 1/20 0.46
PGGT1B P53609 1/20 0.46

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
SCHEMBL24178266 1.00 GNPAT (0.52) GNPATPTPN1LTA4HCTSSCTSK
SCHEMBL24178271 0.95 PTPN1 (0.49) GNPATPTPN1LTA4HCTSSCTSK
SCHEMBL24178269 0.95 PTPN1 (0.49) GNPATPTPN1LTA4HCTSSCTSK
SCHEMBL24178183 0.92 CTSB (0.52) LTA4HANPEPBACE1CTSB
SCHEMBL24178171 0.92 CTSB (0.52) LTA4HANPEPBACE1CTSB
SCHEMBL24178185 0.88 SMN1; SMN2 (0.46) LTA4HANPEPBACE1CTSBFNTA
SCHEMBL24178184 0.88 PTPN1 (0.43) PTPN1LTA4HANPEPMMECTSB
SCHEMBL25466140 0.87 CPA1 (0.50) GNPATPTPN1CTSBCTSL
SCHEMBL25465177 0.87 CPA1 (0.50) GNPATPTPN1CTSBCTSL
SCHEMBL8836882 0.86 GNPAT (0.61) GNPATPTPN1LTA4HANPEPMME

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-11912742-B2 Heterologous production of leupeptin protease inhibitors and analogs thereof YALE UNIVERSITY (US) 2024-02-27 US disclosed
US-20220002354-A1 HETEROLOGOUS PRODUCTION OF LEUPEPTIN PROTEASE INHIBITORS AND ANALOGS THEREOF YALE UNIVERSITY 2022-01-06 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-11912742-B2 Heterologous production of leupeptin protease inhibitors and analogs thereof LPXN, LAP3, PEPD GNPAT 513/4885PTPN1 2403/4885LTA4H 1039/4885
US-20220002354-A1 HETEROLOGOUS PRODUCTION OF LEUPEPTIN PROTEASE INHIBITORS AND ANALOGS THEREOF LPXN, LAP3, PEPD GNPAT 513/4885PTPN1 2403/4885LTA4H 1039/4885

“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.