SCHEMBL31746072

SCHEMBL31746072

CC(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)O)C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PTPN1 P18031 4/20 0.49
▸ CTSL P07711 3/20 0.42
▸ CTSS P25774 3/20 0.42
▸ CTSK P43235 3/20 0.42
▸ CTSH P09668 1/20 0.42
▸ BACE1 P56817 3/20 0.42
▸ BACE2 Q9Y5Z0 2/20 0.42
▸ SIRT5 Q9NXA8 2/20 0.40
▸ GRPR P30550 3/20 0.39
▸ NOD2 Q9HC29 1/20 0.39
▸ ERAP2 Q6P179 1/20 0.37
▸ ERAP1 Q9NZ08 1/20 0.37
▸ LNPEP Q9UIQ6 1/20 0.37
▸ ACE P12821 1/20 0.37
▸ REN P00797 1/20 0.36

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
SCHEMBL21766737 0.87 MAGI3 (0.39) PTPN1CTSLCTSSCTSKCTSH
SCHEMBL24080671 0.87 PTPN1 (0.43) PTPN1CTSLCTSSCTSKCTSH
SCHEMBL30433903 0.86 PTPN1 (0.47) PTPN1BACE1BACE2
SCHEMBL21766788 0.86 SIRT2 (0.41) PTPN1CTSLCTSSCTSKCTSH
SCHEMBL21766696 0.86 BACE1 (0.43) PTPN1CTSLCTSSCTSKCTSH
SCHEMBL21766761 0.86 BACE1 (0.41) PTPN1CTSLCTSSCTSKCTSH
SCHEMBL19051569 0.85 GNPAT (0.40) PTPN1BACE1BACE2SIRT5ERAP2
SCHEMBL23314229 0.85 ERBB2 (0.40) PTPN1CTSLCTSSCTSKCTSH
SCHEMBL21766757 0.85 ERBB2 (0.40) PTPN1CTSLCTSSCTSKCTSH
SCHEMBL21766780 0.85 BACE1 (0.42) PTPN1CTSLCTSSCTSKCTSH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025259133-A1 AC-HIS-ALA-GLU-GLU-NH2 PEPTIDE AND DERIVATIVES THEREOF FOR REMEDYING DEFICIT OF AN ENDOGENOUS COMPONENT OF HUMAN BLOOD Федеральное государственное автономное образовательное учреждение высшего образования "Российский национальный исследовательский медицинский университет имени Н.И. Пирогова" Министерства здравоохранения Российской Федерации 2025-12-18 — — WO disclosed
WO-2025259130-A1 USE OF AC-HIS-ALA-GLU-GLU-NH2 PEPTIDE TO REMEDY DEFICIT OF AN ENDOGENOUS COMPONENT OF ANIMAL BLOOD CONSUMER COOPERATIVE "VSE" 2025-12-18 — — WO disclosed
WO-2025259130-A1 USE OF AC-HIS-ALA-GLU-GLU-NH2 PEPTIDE TO REMEDY DEFICIT OF AN ENDOGENOUS COMPONENT OF ANIMAL BLOOD CONSUMER COOPERATIVE "VSE" 2025-12-18 — — WO disclosed
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