SCHEMBL30717622

SCHEMBL30717622

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NMUR2 Q9GZQ4 5/20 0.50
NTSR2 O95665 1/20 0.49
BACE1 P56817 7/20 0.48
KDM1A O60341 2/20 0.48
NPY1R P25929 1/20 0.47
NPY2R P49146 1/20 0.47
NPY4R P50391 1/20 0.47
NMUR1 Q9HB89 4/20 0.46
IL1RN P18510 1/20 0.46
ERAP2 Q6P179 1/20 0.46
REN P00797 1/20 0.45
FOLH1 Q04609 1/20 0.45
NAALAD2 Q9Y3Q0 1/20 0.45

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
SCHEMBL27986181 0.92 NTSR2 (0.54) NMUR2NTSR2BACE1NPY1RNPY2R
SCHEMBL27986189 0.92 NTSR2 (0.54) NMUR2NTSR2BACE1NPY1RNPY2R
SCHEMBL31391144 0.90 NTSR2 (0.55) NTSR2KDM1ANPY1RNPY2RNPY4R
SCHEMBL30017540 0.88 REN (0.51) BACE1RENNAALAD2
SCHEMBL30750436 0.86 NTSR2 (0.60) NTSR2NPY1RNPY2RNPY4RREN
SCHEMBL30150553 0.86 REN (0.52) BACE1REN
SCHEMBL31178640 0.85 CALCRL (0.55) NMUR2BACE1KDM1A
SCHEMBL30582932 0.85 BACE1 (0.41) BACE1KDM1AREN
SCHEMBL30248946 0.83 NTSR2 (0.55) NTSR2NPY1RNPY2RNPY4RREN
SCHEMBL13599743 0.83 KDM1A (0.55) NMUR2NTSR2KDM1ANMUR1REN

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-117143185-A Anglerfish skin peptide for resisting lipid nephrotoxicity, and preparation method and application thereof 浙江海洋大学 2023-12-01 CN claimed
CN-117143185-A Anglerfish skin peptide for resisting lipid nephrotoxicity, and preparation method and application thereof 浙江海洋大学 2023-12-01 CN disclosed