SCHEMBL30570972

SCHEMBL30570972

CC(C)C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)Cc1ccccc1)C(C)C)C(C)C)C(=O)N[C@@H](CCCCN)C(=O)O

nearest known ligand 0.60

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
OPRK1 P41145 4/20 0.60
BACE1 P56817 10/20 0.55
BACE2 Q9Y5Z0 2/20 0.55
CTSD P07339 2/20 0.55
LTA4H P09960 1/20 0.52
ERAP2 Q6P179 1/20 0.52
LNPEP Q9UIQ6 1/20 0.52

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
SCHEMBL30616045 1.00 OPRK1 (0.60) OPRK1BACE1BACE2CTSDLTA4H
SCHEMBL5576866 0.98 OPRK1 (0.63) OPRK1BACE1BACE2CTSD
SCHEMBL5576870 0.98 OPRK1 (0.63) OPRK1BACE1BACE2CTSD
SCHEMBL29659768 0.94 OPRK1 (0.58) OPRK1BACE1BACE2CTSD
SCHEMBL30616041 0.94 OPRK1 (0.58) OPRK1BACE1BACE2CTSD
SCHEMBL31138045 0.94 OPRK1 (0.66) OPRK1LTA4HERAP2LNPEP
SCHEMBL30578962 0.94 ERAP2 (0.56) OPRK1BACE1BACE2CTSDERAP2
SCHEMBL30849690 0.94 OPRK1 (0.66) OPRK1LTA4HERAP2LNPEP
SCHEMBL30292597 0.94 OPRK1 (0.66) OPRK1LTA4HERAP2LNPEP
SCHEMBL31393817 0.92 BACE1 (0.62) OPRK1BACE1BACE2CTSD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116589528-A Lumbricus guangdong characteristic peptide and application thereof 江阴天江药业有限公司 2023-08-15 CN disclosed