SCHEMBL3353897

SCHEMBL3353897

CCCCc1nc2cnc3cccnc3c2n1CCNC(=O)OC(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 7/20 0.47
KDM4E B2RXH2 2/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ENPP2 Q13822 1/20 0.43
ALDH1A1 P00352 1/20 0.42
HTT P42858 2/20 0.41
GAA P10253 1/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
LMNA P02545 1/20 0.41
TP53 P04637 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.39
MAPT P10636 1/20 0.39
RECQL P46063 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
STING1 Q86WV6 2/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 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
SCHEMBL3355952 0.96 TLR7 (0.48) TLR7KDM4EL3MBTL1TDP1ENPP2
SCHEMBL12888449 0.95 KDM4E (0.44) TLR7KDM4EL3MBTL1TDP1ENPP2
SCHEMBL4147523 0.89 GAA (0.43) KDM4EL3MBTL1TDP1HTTGAA
SCHEMBL6494409 0.87 TLR7 (0.54) TLR7HTTGAALMNATP53
SCHEMBL4156877 0.87 KDM4E (0.44) TLR7KDM4EL3MBTL1TDP1STING1
SCHEMBL1231989 0.86 KDM4E (0.45) TLR7KDM4EL3MBTL1TDP1HTT
SCHEMBL4309229 0.86 STING1 (0.46) KDM4EL3MBTL1TDP1HTTGAA
SCHEMBL3354173 0.86 TLR7 (0.59) TLR7
SCHEMBL5124567 0.85 STING1 (0.46) TLR7KDM4EL3MBTL1TDP1STING1
SCHEMBL5129239 0.85 STING1 (0.46) TLR7KDM4EL3MBTL1TDP1STING1

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 30 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-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-20070167481-A1 IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2007-07-19 US disclosed
US-20060128674-A1 INTERMEDIATES FOR IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2006-06-15 US disclosed
US-7038051-B2 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2006-05-02 US disclosed
US-20050288320-A1 IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY 2005-12-29 US disclosed
US-6949646-B2 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES CO. (US) 2005-09-27 US disclosed
US-20050107421-A1 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2005-05-19 US disclosed
US-6894165-B2 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-05-17 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-20020173653-A1 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2002-11-21 US disclosed
US-20020173654-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 (10 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 135/4885KDM4E 4562/4885L3MBTL1 3804/4885
US-20030083500-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 TLR7 109/4885KDM4E 4437/4885L3MBTL1 4154/4885
US-20030096998-A1 Imidazonaphtyridines IFNG, IRF3, IFNAR1 TLR7 96/4885KDM4E 4492/4885L3MBTL1 4141/4885
US-20070167481-A1 IMIDAZONAPHTHYRIDINES IFNG, IRF3, IFNAR1 TLR7 109/4885KDM4E 4437/4885L3MBTL1 4154/4885
US-20060128674-A1 INTERMEDIATES FOR IMIDAZONAPHTHYRIDINES IFNG, IRF3, MAVS TLR7 135/4885KDM4E 4562/4885L3MBTL1 3804/4885
US-20020173653-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 TLR7 109/4885KDM4E 4437/4885L3MBTL1 4154/4885
US-20020173654-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 TLR7 109/4885KDM4E 4437/4885L3MBTL1 4154/4885
US-20050288320-A1 IMIDAZONAPHTHYRIDINES IFNG, IRF3, IFNAR1 TLR7 109/4885KDM4E 4437/4885L3MBTL1 4154/4885
US-20050107421-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 TLR7 109/4885KDM4E 4437/4885L3MBTL1 4154/4885
US-20030212093-A1 Viricides, antitumor agents IFNG, IFNAR1, MAVS TLR7 116/4885KDM4E 4303/4885L3MBTL1 3375/4885

“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.