SCHEMBL30051626

SCHEMBL30051626

CC(C)[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)CN)C(=O)O

nearest known ligand 0.59

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CTSD P07339 4/20 0.57
▸ CTSB P07858 2/20 0.50
▸ PSMB5 P28074 3/20 0.49
▸ CTSC P53634 2/20 0.49
▸ MME P08473 1/20 0.48
▸ CTSL P07711 1/20 0.48
▸ CTSS P25774 1/20 0.48
▸ ALDH1A1 P00352 1/20 0.48

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
SCHEMBL2520131 0.94 CTSD (0.59) CTSDCTSBCTSC
SCHEMBL2520136 0.94 CTSD (0.59) CTSDCTSBCTSC
SCHEMBL29658166 0.91 MME (0.60) CTSDCTSBPSMB5CTSCMME
SCHEMBL31074731 0.90 OPRD1 (0.49) CTSDMME
SCHEMBL30582928 0.90 OPRD1 (0.49) CTSDMME
SCHEMBL30193614 0.89 OPRD1 (0.56) CTSDCTSB
SCHEMBL11059164 0.89 CTSD (0.59) CTSDPSMB5MME
SCHEMBL11059196 0.89 CTSD (0.59) CTSDPSMB5MME
SCHEMBL30350060 0.89 CTSD (0.57) CTSD
SCHEMBL17770758 0.87 CTSD (0.68) CTSDPSMB5

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-12622975-B2 Peptide-conjugated prodrugs BRANDEIS UNIVERSITY (US) 2026-05-12 — — US disclosed
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2022-12-08 — — 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-12622975-B2 Peptide-conjugated prodrugs PEPD, PAM, VIP CTSD 503/4885CTSB 1507/4885PSMB5 3664/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD CTSD 213/4885CTSB 104/4885PSMB5 3085/4885

“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.

Send feedback