SCHEMBL22925065

SCHEMBL22925065

CC/N=C/c1ccc(F)c(C(F)(F)F)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPFFR1 Q9GZQ6 2/20 0.37
NPFFR2 Q9Y5X5 2/20 0.37
AR P10275 9/20 0.35
KIF11 P52732 1/20 0.35
CTSS P25774 1/20 0.34
CTSK P43235 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
GLA P06280 1/20 0.33
APP P05067 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
MPL P40238 1/20 0.33
KCNN4 O15554 1/20 0.32
PTPN7 P35236 1/20 0.32
DUSP3 P51452 1/20 0.32
HTR2A P28223 1/20 0.32
SLC6A4 P31645 1/20 0.32

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
SCHEMBL21236969 0.81 NPFFR1 (0.40) NPFFR1NPFFR2ARKIF11L3MBTL1
SCHEMBL28117960 0.79 KIF11 (0.42) ARKIF11CTSSCTSKAPP
SCHEMBL2447369 0.77 NPFFR1 (0.43) NPFFR1NPFFR2ARKIF11L3MBTL1
SCHEMBL2447368 0.77 NPFFR1 (0.43) NPFFR1NPFFR2ARKIF11L3MBTL1
SCHEMBL22925145 0.77 ALDH1A1 (0.41) NPFFR1NPFFR2ARKIF11L3MBTL1
SCHEMBL25622482 0.72 NPFFR1 (0.34) NPFFR1NPFFR2ARKIF11L3MBTL1
SCHEMBL25753392 0.72 NPFFR1 (0.34) NPFFR1NPFFR2ARKIF11L3MBTL1
SCHEMBL29110062 0.72 APP (0.42) ARKIF11L3MBTL1APPCYP3A4
SCHEMBL29110066 0.72 APP (0.42) ARKIF11L3MBTL1APPCYP3A4
SCHEMBL16993678 0.71 NPFFR2 (0.71) NPFFR1NPFFR2NPSR1

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-2021012264-A1 TRIAZOLE SULFONAMIDE DERIVATIVE, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 东莞市东阳光农药研发有限公司 2021-01-28 WO disclosed