SCHEMBL31362627

SCHEMBL31362627

CC(C)[C@H](NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N1CCC[C@H]1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.54
▸ MAPK9 P45984 1/20 0.54
▸ MAPK10 P53779 1/20 0.54
▸ KDM1A O60341 3/20 0.52
▸ REN P00797 7/20 0.51
▸ EPHA2 P29317 1/20 0.50
▸ CALCRL Q16602 3/20 0.48
▸ KEAP1 Q14145 1/20 0.48
▸ MAOB P27338 1/20 0.48
▸ KDM5A P29375 1/20 0.48
▸ KDM1B Q8NB78 1/20 0.48

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
SCHEMBL31362676 0.91 CALCRL (0.51) EPHA2CALCRL
SCHEMBL29666827 0.90 MAPK8 (0.59) MAPK8MAPK9MAPK10KDM1AREN
SCHEMBL31186337 0.88 MAPK8 (0.64) MAPK8MAPK9MAPK10KDM1AREN
SCHEMBL29666780 0.87 MAPK8 (0.58) MAPK8MAPK9MAPK10KDM1AEPHA2
SCHEMBL29666767 0.87 MAPK8 (0.58) MAPK8MAPK9MAPK10KDM1AEPHA2
SCHEMBL31165809 0.86 MAPK8 (0.45) MAPK8MAPK9MAPK10KDM1AEPHA2
SCHEMBL29837381 0.86 MAPK8 (0.43) MAPK8MAPK9MAPK10KDM1AKEAP1
SCHEMBL29666790 0.85 MAPK8 (0.64) MAPK8MAPK9MAPK10KDM1AREN
SCHEMBL29666788 0.85 MAPK8 (0.56) MAPK8MAPK9MAPK10KDM1AEPHA2
SCHEMBL29666787 0.85 MAPK8 (0.57) MAPK8MAPK9MAPK10KDM1AREN

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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