SCHEMBL29533774

SCHEMBL29533774

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

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ERAP2 Q6P179 7/20 0.62
▸ ECE1 P42892 7/20 0.60
▸ IL1RN P18510 7/20 0.57
▸ ERAP1 Q9NZ08 3/20 0.57
▸ KDM4E B2RXH2 1/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ LMNA P02545 1/20 0.57
▸ MPO P05164 1/20 0.57
▸ MAPT P10636 1/20 0.57
▸ TSHR P16473 1/20 0.57
▸ BLM P54132 1/20 0.57
▸ PMP22 Q01453 1/20 0.57
▸ KMT2A Q03164 1/20 0.57
▸ HIF1A Q16665 1/20 0.57
▸ ACE P12821 2/20 0.56

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
SCHEMBL30254765 0.94 ERAP2 (0.63) ERAP2ECE1IL1RNERAP1KDM4E
SCHEMBL30465916 0.93 ERAP2 (0.64) ERAP2ECE1IL1RNERAP1KDM4E
SCHEMBL29559633 0.93 ACE (0.62) ERAP2ECE1KDM4EMEN1LMNA
SCHEMBL30051713 0.92 ECE1 (0.63) ERAP2ECE1IL1RNERAP1KDM4E
SCHEMBL30050958 0.92 ECE1 (0.63) ERAP2ECE1IL1RNERAP1ACE
SCHEMBL29538468 0.92 ERAP2 (0.69) ERAP2ECE1IL1RNERAP1KDM4E
SCHEMBL21641804 0.92 KDM4E (0.67) ECE1KDM4EMEN1LMNAMPO
SCHEMBL29638036 0.92 KDM4E (0.67) ECE1KDM4EMEN1LMNAMPO
SCHEMBL29362572 0.92 KDM4E (0.67) ECE1KDM4EMEN1LMNAMPO
SCHEMBL9822472 0.92 KDM4E (0.67) ECE1KDM4EMEN1LMNAMPO

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116836222-A Clam source antioxidant peptide and screening method and application thereof 鲁东大学 2023-10-03 — — CN claimed
US-12622975-B2 Peptide-conjugated prodrugs BRANDEIS UNIVERSITY (US) 2026-05-12 — — US disclosed
CN-116836222-A Clam source antioxidant peptide and screening method and application thereof 鲁东大学 2023-10-03 — — CN disclosed
CN-116836222-A Clam source antioxidant peptide and screening method and application thereof 鲁东大学 2023-10-03 — — CN 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
US-20220133839-A1 PEPTIDE ANALOGUES WITH BRANCHED AMINO ACID PROBE(S) TXP PHARMA GMBH (CH) 2022-05-05 — — 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 831/4885ECE1 1629/4885IL1RN 1655/4885
US-20220387610-A1 PEPTIDE-CONJUGATED PRODRUGS VIP, DNPEP, PEPD ERAP2 87/4885ECE1 997/4885IL1RN 966/4885

“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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