SCHEMBL3350667

SCHEMBL3350667

Nc1nc2c(c3[nH]cnc13)CCNC2

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.33
GDA Q9Y2T3 1/20 0.33
CD44 P16070 1/20 0.32
PNP P00491 1/20 0.31
PI4KA P42356 2/20 0.31
PI4K2B Q8TCG2 2/20 0.31
PI4K2A Q9BTU6 2/20 0.31
PI4KB Q9UBF8 2/20 0.31
LMNA P02545 1/20 0.31
DRD3 P35462 1/20 0.31
XDH P47989 1/20 0.31
LRRK2 Q5S007 1/20 0.31
PARP1 P09874 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
PARP2 Q9UGN5 1/20 0.31
HTR2C P28335 1/20 0.30

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
SCHEMBL1140881 0.80 ACHE (0.41) PDPK1GDALMNA
SCHEMBL6930107 0.80 ACHE (0.40) PDPK1GDAPNPPI4KAPI4K2B
SCHEMBL6244651 0.78 ACHE (0.40) PDPK1GDA
SCHEMBL1457529 0.70 PDPK1 (0.33) PDPK1GDAPI4KAPI4K2BPI4K2A
SCHEMBL3350655 0.70 UHRF1 (0.41) PDPK1GDAPI4KAPI4K2BPI4K2A
SCHEMBL4784920 0.67 PDPK1 (0.33) PDPK1GDAPI4KAPI4K2BPI4K2A
SCHEMBL8149683 0.67 PDPK1 (0.33) PDPK1GDAPI4KAPI4K2BPI4K2A
SCHEMBL5769370 0.66 CD44 (0.35) CD44PARP1TNKS2PARP2HTR2C
SCHEMBL4987970 0.65 CD44 (0.38) CD44LRRK2PARP1TNKS2PARP2
SCHEMBL3356873 0.65 TLR7 (0.49) LMNAHTR2C

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
WO-2007143526-A2 SUBSTITUTED TETRAHYDROIMIDAZONAPHTHYRIDINES AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-12-13 WO 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-20040006098-A1 INDUCE CYTOKINE BIOSYNTHESIS IN ANIMALS 3M INNOVATIVE PROPERTIES COMPANY 2004-01-08 US disclosed
US-20030212093-A1 Viricides, antitumor agents 3M INNOVATIVE PROPERTIES COMPANY 2003-11-13 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 (11 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 PDPK1 1580/4885GDA 196/4885CD44 3664/4885
US-20030083500-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 PDPK1 1970/4885GDA 191/4885CD44 4094/4885
US-20030096998-A1 Imidazonaphtyridines IFNG, IRF3, IFNAR1 PDPK1 1950/4885GDA 205/4885CD44 4138/4885
US-20040006098-A1 INDUCE CYTOKINE BIOSYNTHESIS IN ANIMALS IFNG, IFNAR1, EIF2AK2 PDPK1 1841/4885GDA 195/4885CD44 3498/4885
US-20070167481-A1 IMIDAZONAPHTHYRIDINES IFNG, IRF3, IFNAR1 PDPK1 1970/4885GDA 191/4885CD44 4094/4885
US-20060128674-A1 INTERMEDIATES FOR IMIDAZONAPHTHYRIDINES IFNG, IRF3, MAVS PDPK1 1580/4885GDA 196/4885CD44 3664/4885
US-20020173653-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 PDPK1 1970/4885GDA 191/4885CD44 4094/4885
US-20020173654-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 PDPK1 1970/4885GDA 191/4885CD44 4094/4885
US-20050288320-A1 IMIDAZONAPHTHYRIDINES IFNG, IRF3, IFNAR1 PDPK1 1970/4885GDA 191/4885CD44 4094/4885
US-20050107421-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 PDPK1 1970/4885GDA 191/4885CD44 4094/4885
US-20030212093-A1 Viricides, antitumor agents IFNG, IFNAR1, MAVS PDPK1 3431/4885GDA 87/4885CD44 2904/4885

“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.