SCHEMBL31479010

SCHEMBL31479010

CCOC(=O)c1cc(F)ccc1-c1cc(C2=CCN(C(=O)OC(C)(C)C)C2)cn2c(C)ncc12

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CDK9 P50750 4/20 0.38
KIT P10721 2/20 0.38
GRM5 P41594 5/20 0.37
GRM1 Q13255 5/20 0.37
CCNT1 O60563 1/20 0.37
ENPP2 Q13822 1/20 0.36
WNT3A P56704 1/20 0.35
HPGD P15428 2/20 0.35
PDK4 Q16654 1/20 0.35
TP53 P04637 1/20 0.34
POLB P06746 1/20 0.34
ALDH1A1 P00352 3/20 0.34
GAA P10253 2/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 1/20 0.34
KMT2A Q03164 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
KDM4E B2RXH2 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
SCHEMBL31479915 0.87 CDK9 (0.36) CDK9KITGRM5GRM1CCNT1
SCHEMBL31479648 0.85 KIT (0.36) CDK9KITGRM5GRM1CCNT1
SCHEMBL31479829 0.82 POLB (0.40) HPGDTP53POLBALDH1A1GAA
SCHEMBL31479060 0.82 TP53 (0.40) ENPP2HPGDTP53POLBALDH1A1
SCHEMBL31479084 0.81 CDK9 (0.38) CDK9KITGRM5GRM1CCNT1
SCHEMBL31479237 0.79 POLB (0.45) HPGDTP53POLBALDH1A1GAA
SCHEMBL31479407 0.79 POLB (0.45) HPGDTP53POLBALDH1A1GAA
SCHEMBL31479184 0.79 POLB (0.45) HPGDTP53POLBALDH1A1GAA
SCHEMBL31479302 0.78 KIT (0.43) CDK9KITGRM5GRM1CCNT1
SCHEMBL31479527 0.75 TSHR (0.41) HPGDPOLBALDH1A1GAAMEN1

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