SCHEMBL31410829

SCHEMBL31410829

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

nearest known ligand 0.62

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.62
▸ MAPK9 P45984 1/20 0.62
▸ MAPK10 P53779 1/20 0.62
▸ KEAP1 Q14145 1/20 0.55
▸ REN P00797 13/20 0.53
▸ NPY4R P50391 2/20 0.49
▸ KDM1A O60341 1/20 0.47

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
SCHEMBL31177227 0.97 MAPK8 (0.60) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL29607025 0.92 MAPK8 (0.63) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL29666738 0.90 MAPK8 (0.52) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL30625028 0.89 MAPK8 (0.58) MAPK8MAPK9MAPK10KEAP1
SCHEMBL30624804 0.89 MAPK8 (0.58) MAPK8MAPK9MAPK10KEAP1
SCHEMBL29376375 0.89 KEAP1 (0.60) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL31401835 0.89 KEAP1 (0.65) MAPK8MAPK9MAPK10KEAP1KDM1A
SCHEMBL7174455 0.88 CTSC (0.49) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL7174450 0.88 CTSC (0.49) MAPK8MAPK9MAPK10KEAP1REN
SCHEMBL29387797 0.88 CTSC (0.49) MAPK8MAPK9MAPK10KEAP1REN

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
WO-2025002589-A1 TISSUE EXTRACELLULAR PEPTIDE PATTERNS DEDICATED FOR GENERATION OF ANTI-CANCER VACCINES AGAINST SALIVARY GLAND TUMOR, IDENTIFICATION AND ISOLATION OF SALIVARY GLAND TUMOR SPECIFIC T CELLS IN HUMANS Uniwersytet Gdański (PL) 2025-01-02 — — WO claimed
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