SCHEMBL31413060

SCHEMBL31413060

Cc1cc(F)c(COc2nc3c(cc2I)CCN(C(=O)OC(C)(C)C)C3)c(F)c1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 1/20 0.43
GPR119 Q8TDV5 5/20 0.41
NR1H2 P55055 1/20 0.40
MAPT P10636 2/20 0.39
SLC34A1 Q06495 2/20 0.38
MAPK1 P28482 1/20 0.36
HPGDS O60760 2/20 0.36
MAP3K5 Q99683 1/20 0.36
P2RX3 P56373 1/20 0.35
GRM5 P41594 1/20 0.35
GRM1 Q13255 1/20 0.35
PARP1 P09874 1/20 0.34
TNKS2 Q9H2K2 1/20 0.34
PARP2 Q9UGN5 1/20 0.34
MKNK1 Q9BUB5 1/20 0.34
DDB1 Q16531 1/20 0.34
CRBN Q96SW2 1/20 0.34

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
SCHEMBL30474252 1.00 ESR2 (0.43) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL30474258 0.94 ESR2 (0.42) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL31413131 0.94 ESR2 (0.42) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL30474260 0.92 ESR2 (0.44) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL30474362 0.83 ESR2 (0.47) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL31413137 0.83 ESR2 (0.47) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL30474097 0.83 ESR2 (0.44) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL31413089 0.83 ESR2 (0.44) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL30624374 0.82 ESR2 (0.46) ESR2GPR119NR1H2MAPTSLC34A1
SCHEMBL31413147 0.82 ESR2 (0.45) ESR2GPR119NR1H2MAPTMAPK1

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-119343339-A Heterocyclic GLP-1 agonists 加舒布鲁姆生物公司 2025-01-21 CN disclosed