SCHEMBL28484392

SCHEMBL28484392

O=[N+]([O-])c1cc(Cl)cc2c1[nH]c1ccccc12

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHUK O15111 1/20 0.67
KMT2A Q03164 3/20 0.48
MEN1 O00255 2/20 0.48
NSD2 O96028 1/20 0.48
PLA2G1B P04054 1/20 0.48
POLB P06746 1/20 0.48
PLCG1 P19174 1/20 0.48
ATG4B Q9Y4P1 1/20 0.48
FBP1 P09467 1/20 0.46
NPC1 O15118 2/20 0.46
MAPT P10636 2/20 0.46
L3MBTL1 Q9Y468 2/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
HSP90AA1 P07900 1/20 0.46
RAB9A P51151 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.46
CDK2 P24941 2/20 0.45
CCNB2 O95067 1/20 0.45

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
SCHEMBL16653046 0.86 CHUK (0.64) CHUKKMT2AMEN1FBP1NPC1
SCHEMBL31219119 0.86 CHUK (0.64) CHUKKMT2AMEN1FBP1NPC1
SCHEMBL12619841 0.80 CHUK (1.00) CHUKKMT2AMEN1
SCHEMBL1135541 0.79 PARP1 (0.68) KMT2AFBP1NPC1MAPTL3MBTL1
SCHEMBL30455197 0.79 PARP1 (0.68) KMT2AFBP1NPC1MAPTL3MBTL1
SCHEMBL17950637 0.78 MEN1 (0.51) CHUKKMT2AMEN1POLBFBP1
SCHEMBL28479193 0.78 PARP1 (0.54) CHUKKMT2AMEN1FBP1NPC1
SCHEMBL26164139 0.78 PARP1 (0.71) KMT2AFBP1NPC1MAPTL3MBTL1
SCHEMBL28484391 0.76 CDK2 (0.54) KMT2AMEN1NPC1MAPTL3MBTL1
SCHEMBL27730417 0.76 MAPT (0.48) KMT2AMEN1POLBNPC1MAPT

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111909188-B Compound, luminescent material and organic electroluminescent device 烟台显华化工科技有限公司 2023-07-25 CN disclosed
CN-111909188-A Compound, luminescent material and organic electroluminescent device 烟台显华化工科技有限公司 2020-11-10 CN disclosed