SCHEMBL28089414

SCHEMBL28089414

FC(F)(F)c1ccc2nc(-c3c[nH]c4ccccc34)cnc2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK5 Q00535 2/20 0.50
CDK5R1 Q15078 2/20 0.50
DYRK1A Q13627 3/20 0.48
GSK3B P49841 2/20 0.48
PDGFRB P09619 2/20 0.48
PDGFRA P16234 2/20 0.48
ELANE P08246 2/20 0.46
TDO2 P48775 2/20 0.44
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
CLK1 P49759 1/20 0.43
MAP3K14 Q99558 1/20 0.43
MAPT P10636 3/20 0.42
KDM4E B2RXH2 2/20 0.42
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 1/20 0.42

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
SCHEMBL17179314 0.78 CDK5 (0.54) CDK5CDK5R1DYRK1AGSK3BPDGFRB
SCHEMBL20032698 0.76 MEN1 (0.48) PDGFRBMEN1KMT2AMAPTKDM4E
SCHEMBL20032699 0.74 TLR9 (0.60) PDGFRBMAPTKDM4EALDH1A1SMN1; SMN2
SCHEMBL17179423 0.72 DYRK1A (0.59) DYRK1AGSK3B
SCHEMBL20017671 0.72 CLK1 (0.58) CDK5CDK5R1DYRK1AGSK3BPDGFRB
SCHEMBL28774341 0.71 MAPK1 (0.57) CDK5CDK5R1DYRK1AGSK3BPDGFRB
SCHEMBL20032701 0.70 MEN1 (0.48) PDGFRBMEN1KMT2AMAPTKDM4E
SCHEMBL16666222 0.70 ALOX5AP (0.47) MEN1KMT2AMAPTKDM4EALDH1A1
SCHEMBL17179209 0.70 NR4A2 (0.67) CDK5CDK5R1DYRK1ATDO2HSD17B10
SCHEMBL17179464 0.69 KIF11 (0.50) CDK5CDK5R1DYRK1AGSK3BMAPT

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-105873914-B Substituted quinoxaline derivatives as pest control agents 拜耳作物科学股份公司 2018-10-19 CN disclosed
CN-105873914-A Substituted quinoxaline derivatives as pest control agents 拜耳作物科学股份公司 2016-08-17 CN disclosed