SCHEMBL22925145

SCHEMBL22925145

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.41
GAA P10253 2/20 0.41
KDM4E B2RXH2 2/20 0.41
LMNA P02545 2/20 0.41
RAB9A P51151 2/20 0.39
MAPT P10636 2/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
NPFFR1 Q9GZQ6 2/20 0.37
NPFFR2 Q9Y5X5 2/20 0.37
APP P05067 1/20 0.36
KIF11 P52732 1/20 0.35
AR P10275 2/20 0.35
NPC1 O15118 2/20 0.35
MAPK1 P28482 1/20 0.35
HTR2A P28223 1/20 0.35
SLC6A4 P31645 1/20 0.35
KCNH2 Q12809 1/20 0.35
GRM4 Q14833 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34

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) ALDH1A1GAARAB9AMAPTMEN1
SCHEMBL23709478 0.80 NPC1 (0.49) ALDH1A1GAAKDM4ELMNARAB9A
SCHEMBL22925025 0.78 LMNA (0.60) ALDH1A1KDM4ELMNARAB9AMAPT
SCHEMBL2447369 0.77 NPFFR1 (0.43) ALDH1A1KDM4ERAB9AMAPTMEN1
SCHEMBL2447368 0.77 NPFFR1 (0.43) ALDH1A1KDM4ERAB9AMAPTMEN1
SCHEMBL22925138 0.77 ALDH1A1 (0.44) ALDH1A1GAAKDM4ELMNARAB9A
SCHEMBL16993676 0.77 LMNA (0.44) ALDH1A1KDM4ELMNARAB9AKMT2A
SCHEMBL16993675 0.77 LMNA (0.44) ALDH1A1KDM4ELMNARAB9AKMT2A
SCHEMBL22925065 0.77 NPFFR1 (0.37) NPFFR1NPFFR2APPKIF11AR
Hydrochloric Acid SCHEMBL6510408 0.76 LMNA (0.43) ALDH1A1KDM4ELMNARAB9AKMT2A

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