SCHEMBL31479730

SCHEMBL31479730

CCN(C(=O)c1cc(F)ccc1-c1cc(C2(O)CN(C(=O)OC(C)(C)C)C2)cc2c1cnn2C)C(C)C

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 1/20 0.36
FEN1 P39748 1/20 0.36
HCRTR1 O43613 5/20 0.34
HCRTR2 O43614 5/20 0.34
JAK2 O60674 3/20 0.33
JAK3 P52333 1/20 0.33
PTK2 Q05397 1/20 0.33
GPR119 Q8TDV5 5/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
KCNH2 Q12809 1/20 0.32
JAK1 P23458 2/20 0.32
MET P08581 1/20 0.32
AXL P30530 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SYK P43405 1/20 0.31

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
SCHEMBL31479345 0.94 JAK2 (0.34) ALOX5APFEN1HCRTR1HCRTR2JAK2
SCHEMBL31479536 0.89 JAK2 (0.34) ALOX5APFEN1JAK2JAK3PTK2
SCHEMBL31479437 0.84 HCRTR1 (0.37) HCRTR1HCRTR2MEN1KMT2AKCNH2
SCHEMBL31479852 0.84 GPBAR1 (0.40) ALOX5APFEN1JAK2JAK3PTK2
SCHEMBL31479566 0.83 MEN1 (0.42) ALOX5APFEN1JAK2MEN1KMT2A
SCHEMBL31479353 0.83 ALOX5AP (0.35) ALOX5APFEN1HCRTR1HCRTR2JAK2
SCHEMBL31479737 0.83 CDK9 (0.36) ALOX5APFEN1HCRTR1HCRTR2JAK2
SCHEMBL31479837 0.82 GPR119 (0.39) ALOX5APFEN1GPR119SMN1; SMN2
SCHEMBL31479320 0.82 GPR119 (0.39) ALOX5APFEN1GPR119SMN1; SMN2
SCHEMBL31479262 0.82 GPR119 (0.39) ALOX5APFEN1GPR119SMN1; SMN2

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-2025067111-A1 MENIN-MLL INTERACTION INHIBITOR AND PREPARATION METHOD THEREFOR, AND APPLICATION 苏州必扬医药科技有限公司 2025-04-03 WO disclosed