SCHEMBL5809073

SCHEMBL5809073

CC(C)c1nc2c(N)nc3cccnc3c2n1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 1/20 0.43
TLR8 Q9NR97 10/20 0.40
TLR7 Q9NYK1 9/20 0.40
HTR2A P28223 2/20 0.38
HTR2B P41595 2/20 0.38
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38
HRH2 P25021 1/20 0.38
ADRA1D P25100 1/20 0.38
ADORA2A P29274 1/20 0.38
ADRA1A P35348 1/20 0.38
NUDT1 P36639 1/20 0.38
PDE4D Q08499 1/20 0.38
KCNH2 Q12809 1/20 0.38
HRH4 Q9H3N8 1/20 0.36
PIK3CD O00329 1/20 0.36
ABL1 P00519 1/20 0.36
SRC P12931 1/20 0.36
HTR2C P28335 1/20 0.34
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL4755938 0.80 TLR7 (0.51) TLR8TLR7HTR2AHTR2BLMNA
SCHEMBL10123111 0.72 PRMT5 (0.50) PRMT5TLR8TLR7HTR2AHTR2B
Sotirimod SCHEMBL29395045 0.72 TLR7 (0.50) PRMT5TLR8TLR7HTR2AHTR2B
Sotirimod SCHEMBL191424 0.72 TLR7 (0.50) PRMT5TLR8TLR7HTR2AHTR2B
SCHEMBL4299811 0.72 TLR7 (0.42) PRMT5TLR8TLR7HTR2AHTR2B
Epetirimod SCHEMBL29454521 0.70 TLR7 (0.70) PRMT5TLR8TLR7HTR2AHTR2B
Epetirimod SCHEMBL29350668 0.70 TLR7 (0.70) PRMT5TLR8TLR7HTR2AHTR2B
Epetirimod SCHEMBL544542 0.70 TLR7 (0.70) PRMT5TLR8TLR7HTR2AHTR2B
SCHEMBL193507 0.70 TLR7 (0.49) PRMT5TLR8TLR7HTR2AHTR2B
SCHEMBL5130116 0.70 TLR7 (0.48) PRMT5TLR8TLR7HTR2AHTR2B

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-2006026760-A2 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-09 WO disclosed