SCHEMBL30053106

SCHEMBL30053106

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

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CTSC P53634 3/20 0.69
▸ MEN1 O00255 2/20 0.62
▸ KMT2A Q03164 2/20 0.62
▸ ACE P12821 2/20 0.59
▸ ERAP2 Q6P179 1/20 0.55
▸ ECE1 P42892 6/20 0.55
▸ ALOX15 P16050 1/20 0.54
▸ KDM4E B2RXH2 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ MPO P05164 1/20 0.54
▸ MAPT P10636 1/20 0.54
▸ TSHR P16473 1/20 0.54
▸ BLM P54132 1/20 0.54
▸ PMP22 Q01453 1/20 0.54
▸ HIF1A Q16665 1/20 0.54
▸ CCKBR P32239 2/20 0.53
▸ CCKAR P32238 1/20 0.53

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
SCHEMBL30051830 0.97 CTSC (0.71) CTSCMEN1KMT2AACEERAP2
SCHEMBL30052005 0.96 CTSC (0.69) CTSCMEN1KMT2AACEERAP2
SCHEMBL30052009 0.96 CTSC (0.64) CTSCMEN1KMT2AACEERAP2
SCHEMBL7049417 0.95 CTSC (0.73) CTSCMEN1KMT2AACEECE1
SCHEMBL13154782 0.95 CTSC (0.73) CTSCMEN1KMT2AACEECE1
SCHEMBL7048700 0.95 CTSC (0.73) CTSCMEN1KMT2AACEECE1
SCHEMBL7048698 0.95 CTSC (0.73) CTSCMEN1KMT2AACEECE1
SCHEMBL30051525 0.93 CTSC (0.66) CTSCMEN1KMT2AACEERAP2
SCHEMBL30051544 0.93 CTSC (0.66) CTSCMEN1KMT2AACEERAP2
SCHEMBL30053185 0.93 CTSC (0.61) CTSCMEN1KMT2AACEALOX15

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

“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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