SCHEMBL30051387

SCHEMBL30051387

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

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 6/20 0.68
▸ CTSC P53634 2/20 0.65
▸ ECE1 P42892 6/20 0.64
▸ IL1RN P18510 4/20 0.62
▸ ERAP1 Q9NZ08 4/20 0.62
▸ MEN1 O00255 1/20 0.61
▸ KMT2A Q03164 1/20 0.61
▸ ACE P12821 2/20 0.60
▸ ANPEP P15144 1/20 0.57

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
SCHEMBL30052412 0.96 CTSC (0.65) ERAP2CTSCECE1IL1RNERAP1
SCHEMBL29946873 0.96 ERAP2 (0.63) ERAP2CTSCECE1IL1RNERAP1
SCHEMBL30051830 0.93 CTSC (0.71) ERAP2CTSCECE1MEN1KMT2A
SCHEMBL7048700 0.93 CTSC (0.73) CTSCECE1MEN1KMT2AACE
SCHEMBL7048698 0.93 CTSC (0.73) CTSCECE1MEN1KMT2AACE
SCHEMBL13154782 0.93 CTSC (0.73) CTSCECE1MEN1KMT2AACE
SCHEMBL7049417 0.93 CTSC (0.73) CTSCECE1MEN1KMT2AACE
SCHEMBL30052793 0.93 ECE1 (0.64) ERAP2CTSCECE1IL1RNERAP1
SCHEMBL30051343 0.93 ERAP2 (0.63) ERAP2CTSCECE1IL1RNERAP1
SCHEMBL30052005 0.93 CTSC (0.69) ERAP2CTSCECE1MEN1KMT2A

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 ERAP2 831/4885CTSC 131/4885ECE1 1629/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD ERAP2 87/4885CTSC 37/4885ECE1 997/4885

“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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