SCHEMBL29269366

SCHEMBL29269366

CC(C)(C)OC(=O)N1CCCC(CCOc2ccc(F)c(CN)c2)C1

nearest known ligand 0.58

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GPR119 Q8TDV5 10/20 0.53
SCN9A Q15858 2/20 0.46
ALOX5AP P20292 1/20 0.44
FEN1 P39748 1/20 0.44
CHEK2 O96017 2/20 0.44
CYP2C9 P11712 1/20 0.42
BACE1 P56817 2/20 0.42
CTSD P07339 1/20 0.42

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
SCHEMBL29269441 0.90 GPR119 (0.47) GPR119ALOX5APFEN1CHEK2CYP2C9
SCHEMBL31270437 0.88 GPR119 (0.46) GPR119SCN9AALOX5APFEN1CHEK2
SCHEMBL29269506 0.84 GPR119 (0.52) GPR119SCN9AALOX5APFEN1CHEK2
SCHEMBL31270241 0.84 GPR119 (0.43) GPR119SCN9AALOX5APFEN1CHEK2
SCHEMBL31269794 0.84 GPR119 (0.51) GPR119SCN9ACHEK2
SCHEMBL31270293 0.83 HTR6 (0.47) GPR119ALOX5APFEN1CHEK2CYP2C9
SCHEMBL29269458 0.81 HTR6 (0.44) GPR119SCN9A
SCHEMBL29269459 0.81 HTR6 (0.44) GPR119SCN9A
SCHEMBL13106506 0.81 GPR119 (0.51) GPR119ALOX5APFEN1CHEK2CYP2C9
SCHEMBL31270108 0.80 CHEK2 (0.53) GPR119SCN9AALOX5APFEN1CHEK2

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
CN-118251383-A Macrocyclic compounds as proteasome beta subunit type 5 inhibitors 利德探索中心有限公司 2024-06-25 CN disclosed