SCHEMBL29514711

SCHEMBL29514711

CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 11/20 0.44
CTSD P07339 2/20 0.44
BACE2 Q9Y5Z0 1/20 0.44
ENPEP Q07075 5/20 0.43
OPRD1 P41143 1/20 0.42

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
SCHEMBL29514727 1.00 BACE1 (0.44) BACE1CTSDBACE2ENPEPOPRD1
SCHEMBL29514892 1.00 BACE1 (0.44) BACE1CTSDBACE2ENPEPOPRD1
SCHEMBL29514782 1.00 BACE1 (0.44) BACE1CTSDBACE2ENPEPOPRD1
SCHEMBL31110645 0.95 ENPEP (0.46) BACE1ENPEP
SCHEMBL9059173 0.94 BACE1 (0.46) BACE1CTSDBACE2OPRD1
SCHEMBL9059172 0.94 BACE1 (0.46) BACE1CTSDBACE2OPRD1
SCHEMBL29858382 0.93 GSR (0.46) ENPEP
SCHEMBL29514651 0.92 BACE1 (0.47) BACE1CTSDBACE2ENPEPOPRD1
SCHEMBL30242247 0.89 GNPAT (0.49) BACE1CTSDBACE2ENPEP
SCHEMBL29591590 0.89 CPB2 (0.45) BACE1CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114621318-A Peptide therapy for inflammation and fibrosis 加利福尼亚大学董事会 2022-06-14 CN claimed
CN-114181281-A Peptide therapy for inflammation and fibrosis 加利福尼亚大学董事会 2022-03-15 CN claimed
CN-114621318-A Peptide therapy for inflammation and fibrosis 加利福尼亚大学董事会 2022-06-14 CN disclosed
CN-107531752-B Peptide therapy for inflammation and fibrosis 加利福尼亚大学董事会 2022-05-10 CN disclosed
CN-114181281-A Peptide therapy for inflammation and fibrosis 加利福尼亚大学董事会 2022-03-15 CN disclosed