SCHEMBL3355530

SCHEMBL3355530

Nc1c([N+](=O)[O-])c2nnnn2c2ncccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPY1R P25929 13/20 0.36
LMNA P02545 3/20 0.36
MAPT P10636 3/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
TDP1 Q9NUW8 2/20 0.36
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
BRD4 O60885 1/20 0.36
ALDH1A1 P00352 1/20 0.36
CTSB P07858 1/20 0.36
HSP90AA1 P07900 1/20 0.36
CHRM1 P11229 1/20 0.36
DRD2 P14416 1/20 0.36
ALOX12 P18054 1/20 0.36
ADRA2B P18089 1/20 0.36
ADRA2C P18825 1/20 0.36
CHRM3 P20309 1/20 0.36
HTR2C P28335 1/20 0.36

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
SCHEMBL4302874 0.84 ALDH1A1 (0.39) NPY1RLMNAMAPTSMN1; SMN2TDP1
SCHEMBL3354370 0.84 S100A4 (0.42) LMNAMAPTSMN1; SMN2TDP1MEN1
SCHEMBL842477 0.82 NPY1R (0.36) NPY1RLMNAMAPTSMN1; SMN2TDP1
SCHEMBL6099876 0.81 LMNA (0.40) LMNAMAPTSMN1; SMN2MEN1KMT2A
SCHEMBL3356207 0.80 MAPK1 (0.36) LMNAMAPTMEN1KMT2AKDM4E
SCHEMBL13914465 0.78 MAPT (0.37) LMNAMAPTSMN1; SMN2TDP1MEN1
SCHEMBL13588384 0.76 CYP1A2 (0.32) NPY1RLMNAMAPTSMN1; SMN2TDP1
SCHEMBL12701776 0.76 KDM4E (0.32) NPY1RLMNAMAPTSMN1; SMN2MEN1
SCHEMBL7025149 0.76 MAPT (0.38) LMNAMAPTSMN1; SMN2TDP1MEN1
SCHEMBL3358573 0.75 HASPIN (0.39) LMNAMAPTALDH1A1HTTPOLB

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-8329721-B2 Hydroxy and alkoxy substituted 1H-imidazonaphthyridines and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2012-12-11 US disclosed
US-7678918-B2 Intermediates for imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2010-03-16 US disclosed
US-20090298821-A1 HYDROXY AND ALKOXY SUBSTITUTED IH-IMIDAZONAPHTHYRIDINES AND METHODS PFIZER INC. 2009-12-03 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-20040023932-A1 Imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY 2004-02-05 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-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 (12 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 NPY1R 4820/4885LMNA 2779/4885MAPT 4447/4885
US-20030083500-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 NPY1R 4593/4885LMNA 3209/4885MAPT 4389/4885
US-20090298821-A1 HYDROXY AND ALKOXY SUBSTITUTED IH-IMIDAZONAPHTHYRIDINES AND METHODS IL2, IL4, IFNG NPY1R 3203/4885LMNA 1966/4885MAPT 4278/4885
US-20030096998-A1 Imidazonaphtyridines IFNG, IRF3, IFNAR1 NPY1R 4525/4885LMNA 3119/4885MAPT 4347/4885
US-20040006098-A1 INDUCE CYTOKINE BIOSYNTHESIS IN ANIMALS IFNG, IFNAR1, EIF2AK2 NPY1R 4318/4885LMNA 4373/4885MAPT 4446/4885
US-20070167481-A1 IMIDAZONAPHTHYRIDINES IFNG, IRF3, IFNAR1 NPY1R 4593/4885LMNA 3209/4885MAPT 4389/4885
US-20060128674-A1 INTERMEDIATES FOR IMIDAZONAPHTHYRIDINES IFNG, IRF3, MAVS NPY1R 4820/4885LMNA 2779/4885MAPT 4447/4885
US-20020173653-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 NPY1R 4593/4885LMNA 3209/4885MAPT 4389/4885
US-20020173654-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 NPY1R 4593/4885LMNA 3209/4885MAPT 4389/4885
US-20050288320-A1 IMIDAZONAPHTHYRIDINES IFNG, IRF3, IFNAR1 NPY1R 4593/4885LMNA 3209/4885MAPT 4389/4885
US-20040023932-A1 Imidazonaphthyridines IFNG, IRF3, IFNAR1 NPY1R 4593/4885LMNA 3209/4885MAPT 4389/4885
US-20030212093-A1 Viricides, antitumor agents IFNG, IFNAR1, MAVS NPY1R 4859/4885LMNA 3650/4885MAPT 4481/4885

“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.