SCHEMBL5407050

SCHEMBL5407050

CCc1nc2c(N)nc3ccccc3c2n1NC(C)C

nearest known ligand 0.60

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.60
TLR8 Q9NR97 6/20 0.53
LMNA P02545 1/20 0.49
POLB P06746 1/20 0.49
HRH2 P25021 1/20 0.49
ADRA1D P25100 1/20 0.49
HTR2A P28223 1/20 0.49
ADORA2A P29274 1/20 0.49
ADRA1A P35348 1/20 0.49
NUDT1 P36639 1/20 0.49
HTR2B P41595 1/20 0.49
PDE4D Q08499 1/20 0.49
KCNH2 Q12809 1/20 0.49

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
SCHEMBL4757171 0.91 TLR7 (0.61) TLR7TLR8
SCHEMBL5415456 0.90 TLR7 (0.54) TLR7TLR8LMNAPOLBHRH2
SCHEMBL5415354 0.89 TLR7 (0.62) TLR7TLR8
SCHEMBL544735 0.88 TLR7 (0.62) TLR7TLR8NUDT1
SCHEMBL14594186 0.84 TLR7 (0.55) TLR7TLR8LMNAPOLBHRH2
SCHEMBL4296109 0.82 TLR7 (0.44) TLR7TLR8LMNAPOLBHRH2
SCHEMBL31411154 0.82 TLR7 (0.63) TLR7TLR8LMNAPOLBHRH2
SCHEMBL14594198 0.81 TLR7 (0.49) TLR7TLR8
SCHEMBL5806488 0.80 TLR7 (0.58) TLR7TLR8LMNA
SCHEMBL25093187 0.80 TLR7 (0.67) TLR7TLR8

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2006028451-A1 1-AMINO 1-H-IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-16 WO claimed
US-7163947-B2 1-Amino 1H-imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-01-16 US disclosed
US-7163947-B2 1-Amino 1H-imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-01-16 US disclosed
US-7163947-B2 1-Amino 1H-imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-01-16 US disclosed
WO-2006028451-A1 1-AMINO 1-H-IMIDAZOQUINOLINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-16 WO disclosed
US-20050054640-A1 1-Amino 1H-imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2005-03-10 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050054640-A1 1-Amino 1H-imidazoquinolines IL2, IFNG, IL4I1 TLR7 146/4885TLR8 507/4885LMNA 3863/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.