SCHEMBL31479415

SCHEMBL31479415

CCN(C(=O)c1cc(F)ccc1-c1cc(C2(F)CN(CC3CCC(N)CC3)C2)cn2cncc12)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
KCNH2 Q12809 1/20 0.41
CNR2 P34972 1/20 0.34
HCRTR1 O43613 1/20 0.32
HCRTR2 O43614 1/20 0.32
ACKR3 P25106 3/20 0.30
PDE6D O43924 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
SCHEMBL31479949 0.90 MEN1 (0.53) MEN1KMT2AKCNH2CNR2HCRTR1
SCHEMBL31479427 0.87 MEN1 (0.42) MEN1KMT2AKCNH2CNR2
SCHEMBL31479857 0.84 KCNH2 (0.39) MEN1KMT2AKCNH2HCRTR1HCRTR2
SCHEMBL31479890 0.82 HCRTR1 (0.36) MEN1KMT2AKCNH2CNR2HCRTR1
SCHEMBL31479976 0.82 MEN1 (0.43) MEN1KMT2AKCNH2CNR2HCRTR1
SCHEMBL31479797 0.82 HCRTR1 (0.35) MEN1KMT2AKCNH2HCRTR1HCRTR2
SCHEMBL31479928 0.80 ALOX5AP (0.35) MEN1KMT2AKCNH2CNR2HCRTR1
SCHEMBL31479174 0.80 PDE6D (0.37) MEN1KMT2AKCNH2HCRTR1HCRTR2
SCHEMBL31479148 0.79 MEN1 (0.42) MEN1KMT2AKCNH2CNR2HCRTR1
SCHEMBL31479667 0.79 MEN1 (0.43) MEN1KMT2AKCNH2CNR2HCRTR1

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