SCHEMBL31362670

SCHEMBL31362670

CC[C@H](C)[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CCSC)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC(C)C)C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ APLNR P35414 2/20 0.58
▸ NTSR2 O95665 14/20 0.53
▸ NTSR1 P30989 14/20 0.53
▸ SORT1 Q99523 13/20 0.53
▸ CTSL P07711 3/20 0.51
▸ CTSS P25774 3/20 0.51
▸ CTSK P43235 3/20 0.51
▸ CTSH P09668 1/20 0.51
▸ REN P00797 1/20 0.50

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
SCHEMBL29933838 0.94 APLNR (0.60) APLNRNTSR2NTSR1SORT1CTSL
SCHEMBL29453930 0.89 APLNR (0.60) APLNRCTSLCTSSCTSKCTSH
SCHEMBL30511758 0.87 CALCR (0.58) APLNRCTSLCTSSCTSKCTSH
SCHEMBL30785677 0.87 CALCR (0.58) APLNRCTSLCTSSCTSKCTSH
SCHEMBL29608399 0.87 NTSR2 (0.55) APLNRNTSR2NTSR1SORT1
SCHEMBL30504860 0.85 C5AR1 (0.52) APLNRNTSR2NTSR1SORT1CTSL
SCHEMBL31409175 0.85 C5AR1 (0.53) APLNRNTSR2NTSR1SORT1REN
SCHEMBL29606819 0.84 APLNR (0.57) APLNRCTSLCTSSCTSKCTSH
SCHEMBL30229960 0.84 CTSL (0.51) APLNRNTSR2NTSR1SORT1CTSL
SCHEMBL29607754 0.83 APLNR (0.56) APLNRCTSLCTSSCTSKCTSH

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-119390815-A Whey protein peptide, whey protein fermentation concentrate, and preparation method and application thereof 张少辉 2025-02-07 — — CN claimed
CN-119390815-A Whey protein peptide, whey protein fermentation concentrate, and preparation method and application thereof 张少辉 2025-02-07 — — CN disclosed
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