SCHEMBL31316161

SCHEMBL31316161

CC(C)[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H](C)C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)O)C(C)C

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ XIAP P98170 1/20 0.48
▸ MLX Q9UH92 1/20 0.48
▸ CALCRL Q16602 3/20 0.46
▸ ACE P12821 6/20 0.44
▸ REN P00797 4/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ F2 P00734 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ LTA4H P09960 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ PEPD P12955 1/20 0.44
▸ ALOX15 P16050 1/20 0.44
▸ PTGS1 P23219 1/20 0.44
▸ HTR2A P28223 1/20 0.44
▸ PTGS2 P35354 1/20 0.44
▸ HRH1 P35367 1/20 0.44
▸ THPO P40225 1/20 0.44
▸ PMP22 Q01453 1/20 0.44
▸ HSD17B10 Q99714 1/20 0.44
▸ ACE2 Q9BYF1 1/20 0.44

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
SCHEMBL30423456 0.93 ACE (0.50) XIAPMLXACERENKDM4E
SCHEMBL29696991 0.93 ACE (0.50) XIAPMLXACERENKDM4E
SCHEMBL30596283 0.91 CALCRL (0.45) XIAPMLXCALCRLACEREN
SCHEMBL32667928 0.88 ACE (0.44) XIAPMLXCALCRLACEREN
SCHEMBL29470154 0.86 ACE (0.52) ACERENKDM4EF2LMNA
SCHEMBL31214680 0.86 ACE (0.52) ACERENKDM4EF2LMNA
SCHEMBL31316110 0.86 REN (0.47) XIAPMLXACERENKDM4E
SCHEMBL30399601 0.84 ACE (0.45) ACERENKDM4EF2LMNA
SCHEMBL30792488 0.84 ACE (0.49) CALCRLACERENKDM4EF2
SCHEMBL31265591 0.83 ACE (0.59) ACERENKDM4EF2LMNA

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
CN-119241649-B Pacific-fold-and-flex-fish viscera group ACE (angiotensin converting enzyme) inhibitory peptide as well as preparation method and application thereof 中国水产科学研究院黄海水产研究所 2025-05-16 — — CN disclosed
CN-119241649-A Pacific-fold-and-flex-fish viscera group ACE (angiotensin converting enzyme) inhibitory peptide as well as preparation method and application thereof 中国水产科学研究院黄海水产研究所 2025-01-03 — — CN disclosed
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