SCHEMBL4298976

SCHEMBL4298976

CCOCc1nc2cnc3cccnc3c2n1N

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 8/20 0.38
TLR8 Q9NR97 7/20 0.38
NUDT1 P36639 1/20 0.36
NPC1 O15118 3/20 0.34
RAB9A P51151 5/20 0.34
KMT2A Q03164 2/20 0.34
USP2 O75604 1/20 0.34
MEN1 O00255 1/20 0.34
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.33
PDE1A P54750 2/20 0.33
PDE1B Q01064 2/20 0.33
PDE1C Q14123 2/20 0.33
SMN1; SMN2 Q16637 4/20 0.32
GLA P06280 1/20 0.32
MAPT P10636 1/20 0.32
LMNA P02545 1/20 0.32
PDE10A Q9Y233 1/20 0.32
GAA P10253 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
SCHEMBL4302608 0.85 KDM4E (0.40) TLR7TLR8KMT2AMEN1KDM4E
SCHEMBL4756005 0.82 TLR7 (0.46) TLR7TLR8NUDT1NPC1RAB9A
SCHEMBL4299912 0.80 PDE1A (0.38) TLR7TLR8PDE1APDE1BPDE1C
SCHEMBL4296333 0.80 TLR7 (0.34) TLR7TLR8NUDT1NPC1KMT2A
SCHEMBL3353822 0.80 AVPR1A (0.43) TLR7TLR8NUDT1KMT2AMEN1
SCHEMBL5616310 0.79 ALDH1A1 (0.42) TLR7TLR8NUDT1NPC1RAB9A
SCHEMBL1895061 0.79 TLR7 (0.56) TLR7TLR8NUDT1KMT2AMEN1
SCHEMBL4310319 0.79 TLR8 (0.39) TLR7TLR8NUDT1RAB9AKMT2A
SCHEMBL4320577 0.78 TLR8 (0.40) TLR7TLR8NUDT1RAB9AKMT2A
SCHEMBL5617162 0.78 TLR8 (0.39) TLR7TLR8NUDT1RAB9AKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS COLEY PHARMACEUTICAL GROUP, INC. 2009-10-29 US disclosed
WO-2006026760-A2 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-03-09 WO 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-20090270443-A1 1-AMINO IMIDAZO-CONTAINING COMPOUNDS AND METHODS IL2, IL4I1, IFNG TLR7 188/4885TLR8 208/4885NUDT1 690/4885

“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.