SCHEMBL30199670

SCHEMBL30199670

CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@@H]1CCCN1)C(=O)N[C@@H](CCC(=O)O)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)O

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ MAPK8 P45983 1/20 0.46
▸ MAPK9 P45984 1/20 0.46
▸ MAPK10 P53779 1/20 0.46
▸ KDM1A O60341 3/20 0.45
▸ CAPN1 P07384 4/20 0.45
▸ REN P00797 5/20 0.44
▸ NMUR2 Q9GZQ4 1/20 0.43
▸ KEAP1 Q14145 3/20 0.43
▸ MAOB P27338 1/20 0.42
▸ KDM5A P29375 1/20 0.42
▸ KDM1B Q8NB78 1/20 0.42
▸ CTSB P07858 1/20 0.42
▸ F2 P00734 1/20 0.41

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
SCHEMBL30198552 0.91 KDM1A (0.46) MAPK8MAPK9MAPK10KDM1ACAPN1
SCHEMBL31259383 0.91 REN (0.43) MAPK8MAPK9MAPK10CAPN1REN
SCHEMBL30019633 0.89 KDM1A (0.45) MAPK8MAPK9MAPK10KDM1AREN
SCHEMBL30198364 0.89 KDM1A (0.48) MAPK8MAPK9MAPK10KDM1ACAPN1
SCHEMBL30311259 0.86 MAPK8 (0.46) MAPK8MAPK9MAPK10KDM1ACAPN1
SCHEMBL8936975 0.86 MAPK8 (0.48) MAPK8MAPK9MAPK10KDM1ACAPN1
SCHEMBL8936981 0.86 MAPK8 (0.48) MAPK8MAPK9MAPK10KDM1ACAPN1
SCHEMBL30400982 0.86 MAPK8 (0.48) MAPK8MAPK9MAPK10KDM1AREN
SCHEMBL31026619 0.86 CAPN1 (0.52) CAPN1NMUR2KEAP1CTSBF2
SCHEMBL29977789 0.85 MAPK8 (0.46) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11566048-B2 Peptide that regulates fat metabolism and method for regulating fat metabolism SHENZHEN INSTITUTES OF ADVANCED TECHNOLOGY (CN) 2023-01-31 — — US disclosed
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