SCHEMBL1665444

SCHEMBL1665444

FC(F)(F)c1ccnc2scnc12

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.37
PI4K2B Q8TCG2 1/20 0.37
PI4K2A Q9BTU6 1/20 0.37
PI4KB Q9UBF8 1/20 0.37
ALDH1A1 P00352 4/20 0.36
TDP1 Q9NUW8 3/20 0.36
SLC40A1 Q9NP59 1/20 0.31
TTK P33981 1/20 0.31
NCF1 P14598 1/20 0.31
CYP1A2 P05177 4/20 0.31
CYP3A4 P08684 4/20 0.31
TSHR P16473 3/20 0.31
CYP2C19 P33261 3/20 0.31
HSD17B10 Q99714 2/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
HIF1A Q16665 1/20 0.31
NR1H2 P55055 1/20 0.31
NR1H3 Q13133 1/20 0.31
CYP2D6 P10635 2/20 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
SCHEMBL13400630 0.85 PI4KA (0.37) PI4KAPI4K2BPI4K2API4KB
SCHEMBL28083151 0.74 NCF1 (0.41) ALDH1A1TDP1SLC40A1NCF1CYP1A2
SCHEMBL1009034 0.74 CCR1 (0.41) PI4KAPI4K2BPI4K2API4KB
SCHEMBL31389937 0.69 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KBFBP1
SCHEMBL15689524 0.69 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KB
SCHEMBL20674652 0.69 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KBTSHR
SCHEMBL12395178 0.69 PI4KA (0.41) PI4KAPI4K2BPI4K2API4KBFBP1
SCHEMBL13586024 0.69 PI4KA (0.50) PI4KAPI4K2BPI4K2API4KBALDH1A1
SCHEMBL25803189 0.69 CYP3A4 (0.37) CYP3A4TSHRCYP2C19CYP2D6
SCHEMBL15465950 0.69 ALDH1A1 (0.41) ALDH1A1TDP1NCF1HSD17B10PARP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2739624-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL Sumitomo Chemical Company, Limited (JP) 2014-06-11 EP disclosed
WO-2013018928-A1 FUSED HETEROCYCLIC COMPOUND AND USE THEREOF FOR PEST CONTROL SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-02-07 WO disclosed
WO-2011043404-A1 HETEROCYCLIC COMPOUND AND ITS USE FOR CONTROL OF AN ARTHROPOD PEST SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-04-14 WO disclosed