SCHEMBL23609405

SCHEMBL23609405

CSNCCn1cccn1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.35
TLR7 Q9NYK1 1/20 0.35
DAO P14920 1/20 0.35
THRB P10828 2/20 0.35
KDM4E B2RXH2 3/20 0.34
ALDH1A1 P00352 2/20 0.34
MAPK1 P28482 1/20 0.34
FDPS P14324 1/20 0.33
NLRP3 Q96P20 1/20 0.33
KMT2A Q03164 2/20 0.33
MEN1 O00255 1/20 0.33
LMNA P02545 2/20 0.33
NAMPT P43490 2/20 0.33
TSHR P16473 1/20 0.32
PKM P14618 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
SCHEMBL22435126 0.81 DAO (0.35) TLR8TLR7DAOTHRBFDPS
SCHEMBL3477001 0.78 KDM4E (0.38) TLR8TLR7DAOTHRBKDM4E
SCHEMBL1455889 0.78
SCHEMBL18191068 0.74
SCHEMBL14406687 0.74
SCHEMBL5713341 0.73 DAO (0.50) DAOTHRBFDPSLMNATSHR
SCHEMBL20079252 0.73 ADRB2 (0.40) TLR8TLR7DAOTHRBKDM4E
SCHEMBL22762248 0.73 MITF (0.41) TLR8TLR7DAOTHRBKDM4E
SCHEMBL3634182 0.73 TLR8 (0.35) TLR8TLR7DAOTHRBKDM4E
SCHEMBL33257 0.72

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-2021133689-A2 LIPOXYGENASE INHIBITORS SRI INTERNATIONAL (US) 2021-07-01 WO disclosed