SCHEMBL25779264

SCHEMBL25779264

N#Cc1cccc(-c2sncc2C(=O)O)c1

nearest known ligand 0.55

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC22A12 Q96S37 3/20 0.55
XDH P47989 1/20 0.55
F11 P03951 1/20 0.45
PIN1 Q13526 1/20 0.45
HTT P42858 1/20 0.43
EIF4E P06730 2/20 0.43
CLK4 Q9HAZ1 1/20 0.42
CSF1R P07333 1/20 0.42
GABRA1 P14867 1/20 0.42
GABRG2 P18507 1/20 0.42
GABRB3 P28472 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
NOTUM Q6P988 2/20 0.41
FNTA P49354 1/20 0.41
FNTB P49356 1/20 0.41
IDO1 P14902 2/20 0.40
EGLN1 Q9GZT9 1/20 0.40

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
SCHEMBL25779230 0.82 SLC22A12 (0.43) SLC22A12XDHEIF4EEGLN1
SCHEMBL2116877 0.78 LDHA (0.45)
SCHEMBL25778956 0.78 SLC22A12 (0.48) SLC22A12XDHF11PIN1EIF4E
SCHEMBL25779235 0.77 MYC (0.47) XDH
SCHEMBL25778924 0.75 SLC22A12 (0.55) SLC22A12XDHF11PIN1HTT
SCHEMBL5085509 0.75 SLC22A12 (0.61) SLC22A12XDHF11PIN1HTT
SCHEMBL25779225 0.74 EGLN2 (0.34) SLC22A12XDHEGLN1
SCHEMBL25779233 0.73 BRS3 (0.38) SLC22A12XDHHTT
SCHEMBL13398664 0.72 KDM4E (0.63) SLC22A12XDHF11PIN1EIF4E
SCHEMBL25779259 0.72 XDH (0.55) SLC22A12XDHF11PIN1HTT

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-2023118434-A1 PESTICIDALLY ACTIVE AMIDE COMPOUNDS GLOBACHEM NV (BE) 2023-06-29 WO disclosed