SCHEMBL7996606

SCHEMBL7996606

CC[C@H](C)[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)Cc1c[nH]cn1)C(=O)N[C@H](C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)O)[C@@H](C)CC

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EDNRA P25101 1/20 0.67
▸ ERAP2 Q6P179 6/20 0.56
▸ ECE1 P42892 5/20 0.51
▸ ERAP1 Q9NZ08 4/20 0.51
▸ IL1RN P18510 4/20 0.51
▸ MMP2 P08253 2/20 0.49
▸ MMP9 P14780 1/20 0.49
▸ MMP8 P22894 1/20 0.49
▸ MMP1 P03956 1/20 0.49
▸ GLP1R P43220 4/20 0.49
▸ KMT2A Q03164 1/20 0.48
▸ L3MBTL1 Q9Y468 1/20 0.48
▸ ANPEP P15144 1/20 0.48
▸ CASP1 P29466 1/20 0.47
▸ CASP3 P42574 1/20 0.47
▸ CASP4 P49662 1/20 0.47
▸ CASP5 P51878 1/20 0.47
▸ CASP7 P55210 1/20 0.47
▸ CASP9 P55211 1/20 0.47
▸ CASP6 P55212 1/20 0.47

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
SCHEMBL7996597 1.00 EDNRA (0.67) EDNRAERAP2ECE1ERAP1IL1RN
SCHEMBL30045857 0.99 EDNRA (0.68) EDNRAERAP2ECE1ERAP1IL1RN
SCHEMBL30533172 0.96 EDNRA (0.61) EDNRAERAP2ECE1MMP2MMP9
SCHEMBL30045692 0.94 EDNRA (0.60) EDNRAERAP2ECE1ERAP1IL1RN
SCHEMBL30533194 0.94 EDNRA (0.60) EDNRAERAP2GLP1R
SCHEMBL7261791 0.94 EDNRA (0.65) EDNRAERAP2ECE1ERAP1IL1RN
SCHEMBL7261793 0.94 EDNRA (0.65) EDNRAERAP2ECE1ERAP1IL1RN
SCHEMBL30533198 0.93 EDNRA (0.57) EDNRAERAP2ECE1GLP1RKMT2A
SCHEMBL30533164 0.92 EDNRA (0.59) EDNRAERAP2ECE1MMP2MMP9
SCHEMBL30533184 0.91 EDNRA (0.76) EDNRAERAP2ECE1ERAP1IL1RN

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1134158-A N-alkyl peptide chelate formers, their metal complexes with radionuclides, processes for producing them and radio-pharmaceutical compositions contg. these compounds DIAGNOSTIKFORSCHUNG INST (DE) 1996-10-23 — — CN claimed
CN-1134159-A Cysteine-free metal-binding peptides for diagnostic and therapeutic purposes, method for the production thereof and medicaments containing these compounds DIAGNOSTIKFORSCHUNG INST (DE) 1996-10-23 — — CN claimed
US-12460177-B2 Composition for promoting efficiency of somatic cell replication SEOUL NATIONAL UNIVERSITY HOSPITAL (KR) 2025-11-04 — — US disclosed
WO-2024005124-A1 METHOD FOR PRODUCING NON-HUMAN PRIMATE MODEL OF CEREBRAL INFARCTION AND PHARMACEUTICAL COMPOSITION FOR TREATING CEREBRAL INFARCTION アステラス製薬株式会社 2024-01-04 — — WO disclosed
CN-1073116-C Cysteine-free metal complex peptides, method for the production thereof and radiopharmaceutical preparations DIAGNOSTIKFORSCHUNG INST (DE) 2001-10-17 — — CN disclosed
US-6291639-B1 ORGAN-SPECIFIC PROBES FOR TUMOR OR INFLAMMATION IMAGING; KITS WITH RADIISOTOPES INSTITUT FUE DIAGNOSTIKFORSCHUNG GMBH (DE) 2001-09-18 — — US disclosed
CN-1134158-A N-alkyl peptide chelate formers, their metal complexes with radionuclides, processes for producing them and radio-pharmaceutical compositions contg. these compounds DIAGNOSTIKFORSCHUNG INST (DE) 1996-10-23 — — CN disclosed
CN-1134159-A Cysteine-free metal-binding peptides for diagnostic and therapeutic purposes, method for the production thereof and medicaments containing these compounds DIAGNOSTIKFORSCHUNG INST (DE) 1996-10-23 — — CN disclosed
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