SCHEMBL31479690

SCHEMBL31479690

CCN(C(=O)c1cc(F)ccc1-c1cc([C@H]2CCN(CC3(O)CCC(NC(=O)OC(C)(C)C)CC3)C2)cc2c1cnn2C)C(C)C

nearest known ligand 0.34

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
KCNH2 Q12809 1/20 0.34
PLK1 P53350 1/20 0.33
CCNT1 O60563 1/20 0.33
CDK9 P50750 1/20 0.33
IRAK4 Q9NWZ3 1/20 0.32
NPY5R Q15761 4/20 0.32
TP53 P04637 2/20 0.32
LMNA P02545 1/20 0.32
CCR5 P51681 1/20 0.32
KCNA3 P22001 1/20 0.31
NTRK1 P04629 2/20 0.31
ALOX5AP P20292 1/20 0.31
FEN1 P39748 1/20 0.31
NSD2 O96028 1/20 0.31
EGFR P00533 1/20 0.30
LCK P06239 1/20 0.30
JAK3 P52333 1/20 0.30

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
SCHEMBL31479073 1.00 MEN1 (0.34) MEN1KMT2AKCNH2PLK1CCNT1
SCHEMBL31479694 1.00 MEN1 (0.34) MEN1KMT2AKCNH2PLK1CCNT1
SCHEMBL31479214 0.88 KCNH2 (0.42) MEN1KMT2AKCNH2
SCHEMBL31479046 0.88 KCNH2 (0.42) MEN1KMT2AKCNH2
SCHEMBL31479440 0.88 KCNH2 (0.42) MEN1KMT2AKCNH2
SCHEMBL31479492 0.88 HTR2A (0.33) MEN1KMT2AKCNH2
SCHEMBL31479012 0.88 HTR2A (0.33) MEN1KMT2AKCNH2
SCHEMBL31478938 0.88 HTR2A (0.33) MEN1KMT2AKCNH2
SCHEMBL31478983 0.87 MEN1 (0.35) MEN1KMT2AKCNH2IRAK4NPY5R
SCHEMBL31479903 0.86 CCR5 (0.37) PLK1CCNT1CDK9NPY5RTP53

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