SCHEMBL30801476

SCHEMBL30801476

O=C(Cl)c1nccnc1C(F)(F)F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.37
HSD17B10 Q99714 1/20 0.37
GLA P06280 1/20 0.35
TLR7 Q9NYK1 3/20 0.35
KDM4E B2RXH2 3/20 0.33
ASPH Q12797 3/20 0.33
KDM8 Q8N371 2/20 0.33
NPC1 O15118 1/20 0.32
ATM Q13315 1/20 0.32
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
BLM P54132 1/20 0.31
AGER Q15109 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
CNR2 P34972 2/20 0.31
DHODH Q02127 1/20 0.31

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
SCHEMBL629620 1.00 HTT (0.37) HTTHSD17B10GLATLR7KDM4E
SCHEMBL30779709 0.83 KDM4E (0.44) HTTHSD17B10GLATLR7KDM4E
SCHEMBL630383 0.83 KDM4E (0.44) HTTHSD17B10GLATLR7KDM4E
SCHEMBL4570471 0.81 HTT (0.38) HTTHSD17B10GLATLR7KDM4E
Hydrochloric Acid SCHEMBL629621 0.81 KDM4E (0.42) HTTHSD17B10GLATLR7KDM4E
SCHEMBL29936207 0.79 ADORA3 (0.41) HTTHSD17B10GLATLR7KDM4E
SCHEMBL4570470 0.79 GLA (0.38) HTTHSD17B10GLATLR7KDM4E
SCHEMBL212115 0.79 ADORA3 (0.41) HTTHSD17B10GLATLR7KDM4E
SCHEMBL698878 0.77 TSHR (0.37) TLR7KDM4EASPHKDM8MAPT
SCHEMBL23221405 0.75 TLR7 (0.39) HTTHSD17B10GLATLR7KDM4E

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
CN-117551037-A Compounds as succinate dehydrogenase inhibitors and uses thereof 华东理工大学 2024-02-13 CN disclosed