SCHEMBL3353426

SCHEMBL3353426

Cc1nc2c(N)nc3cnccc3c2n1CC(C)C

nearest known ligand 0.52

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.52
TLR8 Q9NR97 2/20 0.44
HTR2A P28223 2/20 0.43
HTR2B P41595 2/20 0.43
LMNA P02545 1/20 0.43
POLB P06746 1/20 0.43
HRH2 P25021 1/20 0.43
ADRA1D P25100 1/20 0.43
ADORA2A P29274 1/20 0.43
ADRA1A P35348 1/20 0.43
NUDT1 P36639 1/20 0.43
PDE4D Q08499 1/20 0.43
KCNH2 Q12809 1/20 0.43
HTR2C P28335 1/20 0.39

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
SCHEMBL5362820 0.83 TLR7 (0.60) TLR7TLR8
SCHEMBL8572870 0.83 TLR7 (0.74) TLR7TLR8HTR2AHTR2BLMNA
SCHEMBL3352917 0.82 TLR7 (0.69) TLR7TLR8
SCHEMBL16705242 0.79 TLR7 (0.69) TLR7TLR8HTR2AHTR2BLMNA
SCHEMBL10123109 0.79 TLR7 (0.43) TLR7
SCHEMBL3352257 0.78 TLR7 (0.71) TLR7TLR8HTR2AHTR2BLMNA
Sotirimod SCHEMBL29395045 0.76 TLR7 (0.50) TLR7TLR8HTR2AHTR2BLMNA
Sotirimod SCHEMBL191424 0.76 TLR7 (0.50) TLR7TLR8HTR2AHTR2BLMNA
SCHEMBL3231917 0.75 TLR7 (0.49) TLR7TLR8HTR2AHTR2BLMNA
SCHEMBL1301553 0.74 TLR7 (0.57) 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 38 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7678918-B2 Intermediates for imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-03-16 US disclosed
US-7678918-B2 Intermediates for imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-03-16 US disclosed
US-7678918-B2 Intermediates for imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-03-16 US disclosed
US-20080091010-A1 Intermediates for imidazonaphthyridines GRACEWAY PHARMACEUTICALS, LLC (US) 2008-04-17 US disclosed
US-20080091010-A1 Intermediates for imidazonaphthyridines GRACEWAY PHARMACEUTICALS, LLC (US) 2008-04-17 US disclosed
US-20080091010-A1 Intermediates for imidazonaphthyridines GRACEWAY PHARMACEUTICALS, LLC (US) 2008-04-17 US disclosed
US-7335773-B2 Intermediates for imidazonaphthyridines GRACEWAY PHARMACEUTICALS, LLC (US) 2008-02-26 US disclosed
US-7335773-B2 Intermediates for imidazonaphthyridines GRACEWAY PHARMACEUTICALS, LLC (US) 2008-02-26 US disclosed
US-7335773-B2 Intermediates for imidazonaphthyridines GRACEWAY PHARMACEUTICALS, LLC (US) 2008-02-26 US disclosed
US-20070167481-A1 IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2007-07-19 US disclosed
US-20030212093-A1 Viricides, antitumor agents 3M INNOVATIVE PROPERTIES COMPANY 2003-11-13 US disclosed
US-6638944-B2 Have urea containing substituent at 1-position; induce biosynthesis of cytokines such as interferon and tumor necrosis factor, exhibit antiviral and antitumor properties 3M INNOVATIVE PROPERTIES COMPANY 2003-10-28 US disclosed
US-6624172-B2 Imidazonaphthyridine and tetrahydroimidazonaphthyridine compounds induce the biosynthesis of cytokines such as interferon and tumor necrosis factor, and useful as viricides and antitumor agents 3M INNOVATIVE PROPERTIES COMPANY 2003-09-23 US disclosed
US-20030096998-A1 Imidazonaphtyridines 3M INNOVATIVE PROPERTIES COMPANY 2003-05-22 US disclosed
US-20030083500-A1 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2003-05-01 US disclosed
US-6518280-B2 Antiviral and antitumor properties; immunomodulators and for inducing cytokine biosynthesis in animals 3M INNOVATIVE PROPERTIES COMPANY 2003-02-11 US disclosed
US-6514985-B1 Induce the biosynthesis of cytokines such as interferon and tumor necrosis factor; exhibit antiviral and antitumor properties 3M INNOVATIVE PROPERTIES COMPANY 2003-02-04 US disclosed
US-20020173654-A1 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2002-11-21 US disclosed
US-20020173653-A1 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2002-11-21 US disclosed
US-6194425-B1 VIRICIDES, ANTITUMOR AGENTS 3M INNOVATIVE PROPERTIES COMPANY 2001-02-27 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 (7 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-20080091010-A1 Intermediates for imidazonaphthyridines IFNG, IRF3, MAVS TLR7 135/4885TLR8 182/4885HTR2A 3969/4885
US-20030083500-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 TLR7 109/4885TLR8 186/4885HTR2A 3705/4885
US-20030096998-A1 Imidazonaphtyridines IFNG, IRF3, IFNAR1 TLR7 96/4885TLR8 172/4885HTR2A 3627/4885
US-20070167481-A1 IMIDAZONAPHTHYRIDINES IFNG, IRF3, IFNAR1 TLR7 109/4885TLR8 186/4885HTR2A 3705/4885
US-20020173653-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 TLR7 109/4885TLR8 186/4885HTR2A 3705/4885
US-20020173654-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 TLR7 109/4885TLR8 186/4885HTR2A 3705/4885
US-20030212093-A1 Viricides, antitumor agents IFNG, IFNAR1, MAVS TLR7 116/4885TLR8 292/4885HTR2A 4032/4885

“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.