SCHEMBL30051165

SCHEMBL30051165

CC[C@H](C)[C@H](NC(=O)[C@@H](N)CCSC)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 3/20 0.62
▸ KMT2A Q03164 2/20 0.59
▸ MEN1 O00255 1/20 0.59
▸ ACE P12821 2/20 0.57
▸ L3MBTL1 Q9Y468 1/20 0.56
▸ EDNRA P25101 1/20 0.56
▸ ECE1 P42892 8/20 0.54
▸ MAGI3 Q5TCQ9 1/20 0.53
▸ ERAP2 Q6P179 1/20 0.52

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
SCHEMBL30051812 0.93 CTSC (0.57) CTSCKMT2AMEN1ACEL3MBTL1
SCHEMBL30052751 0.93 CTSC (0.62) CTSCKMT2AMEN1ACEL3MBTL1
SCHEMBL11228723 0.92 CTSC (0.65) CTSCKMT2AMEN1ACEECE1
SCHEMBL11228707 0.92 CTSC (0.65) CTSCKMT2AMEN1ACEECE1
Hydrochloric Acid SCHEMBL11220807 0.91 CTSC (0.64) CTSCKMT2AMEN1ACEECE1
SCHEMBL29379360 0.91 CTSC (0.64) CTSCKMT2AMEN1ACEECE1
SCHEMBL7048698 0.91 CTSC (0.73) CTSCKMT2AMEN1ACEECE1
SCHEMBL13154782 0.91 CTSC (0.73) CTSCKMT2AMEN1ACEECE1
SCHEMBL7049417 0.91 CTSC (0.73) CTSCKMT2AMEN1ACEECE1
SCHEMBL7048700 0.91 CTSC (0.73) CTSCKMT2AMEN1ACEECE1

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 CTSC 131/4885KMT2A 1801/4885MEN1 1217/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD CTSC 37/4885KMT2A 4547/4885MEN1 1147/4885

“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.

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