SCHEMBL31479366

SCHEMBL31479366

CCN(C(=O)c1cc(F)ccc1-c1cc(N2CCN(C(=O)OC(C)(C)C)CC2)cn2c(C)nc(Cl)c12)C(C)C

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.39
P2RX7 Q99572 1/20 0.38
MAPT P10636 2/20 0.38
GPR119 Q8TDV5 2/20 0.36
SUV39H2 Q9H5I1 8/20 0.36
IDO1 P14902 1/20 0.36
TDO2 P48775 1/20 0.36
IDO2 Q6ZQW0 1/20 0.36
MDM4 O15151 1/20 0.36
MDM2 Q00987 1/20 0.36
PDK2 Q15119 1/20 0.36
MEN1 O00255 1/20 0.36
TSHR P16473 1/20 0.36
KMT2A Q03164 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
MET P08581 1/20 0.35

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
SCHEMBL31479282 0.88 PREP (0.38) ENPP2P2RX7MAPTGPR119
SCHEMBL31478993 0.87 ENPP2 (0.37) ENPP2MAPTGPR119PDK2MEN1
SCHEMBL31479368 0.87 HCRTR1 (0.34) IDO1TDO2IDO2
SCHEMBL31479007 0.87 GPBAR1 (0.37) ENPP2GPR119MEN1KMT2ASMN1; SMN2
SCHEMBL31479790 0.85 CKS1B (0.37) ENPP2MAPTGPR119SUV39H2PDK2
SCHEMBL31479143 0.84 MAPT (0.40) ENPP2MAPTGPR119PDK2MEN1
SCHEMBL31479674 0.83 ENPP2 (0.37) ENPP2MAPTGPR119PDK2MEN1
SCHEMBL31479463 0.83 MEN1 (0.39) MAPTMEN1KMT2A
SCHEMBL31479996 0.83 GPR119 (0.37) ENPP2MAPTGPR119IDO1PDK2
SCHEMBL31479700 0.81 RET (0.37) ENPP2MAPTGPR119PDK2MEN1

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