SCHEMBL5111244

SCHEMBL5111244

CCOCc1nc2c(N)nc3ccccc3c2n1CCOCCN

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 12/20 1.00
TLR7 Q9NYK1 19/20 0.72
NUDT1 P36639 1/20 0.66

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
SCHEMBL17951269 0.94 TLR8 (0.88) TLR8TLR7NUDT1
SCHEMBL13999937 0.93 TLR8 (0.86) TLR8TLR7NUDT1
SCHEMBL1616206 0.91 TLR8 (0.84) TLR8TLR7NUDT1
SCHEMBL15441707 0.91 TLR8 (0.83) TLR8TLR7NUDT1
Hydrochloric Acid SCHEMBL6493853 0.90 TLR8 (0.82) TLR8TLR7NUDT1
Hydrochloric Acid SCHEMBL3863644 0.90 TLR8 (0.82) TLR8TLR7NUDT1
SCHEMBL5113045 0.90 TLR8 (0.82) TLR8TLR7NUDT1
SCHEMBL173461 0.89 TLR8 (0.81) TLR8TLR7NUDT1
SCHEMBL6105673 0.89 TLR8 (0.81) TLR8TLR7NUDT1
SCHEMBL1952956 0.89 TLR8 (0.80) TLR8TLR7NUDT1

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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040067975-A1 Amido ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-04-08 US claimed
US-6664265-B2 Amido ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-12-16 US claimed
US-20030187016-A1 Amido ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-10-02 US claimed
EP-3134402-B1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS HOFFMANN LA ROCHE (CH) 2020-05-06 EP disclosed
US-9447097-B2 4-amino-imidazoquinoline compounds HOFFMANN-LA ROCHE INC. (US) 2016-09-20 US disclosed
US-20160222010-A1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2016-08-04 US disclosed
US-9334268-B2 4-amino-imidazoquinoline compounds HOFFMAN-LA ROCHE INC. (US) 2016-05-10 US disclosed
US-20150299194-A1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS HOFFMANN-LA ROCHE INC. (US) 2015-10-22 US disclosed
US-20080306252-A1 SULFONAMIDO ETHER SUBSTITUTED IMIDAZOQUINOLINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-12-11 US disclosed
US-20080306252-A1 SULFONAMIDO ETHER SUBSTITUTED IMIDAZOQUINOLINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-12-11 US disclosed
US-20080306252-A1 SULFONAMIDO ETHER SUBSTITUTED IMIDAZOQUINOLINES COLEY PHARMACEUTICAL GROUP, INC. (US) 2008-12-11 US disclosed
US-20040097542-A1 Sulfonamido ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-05-20 US disclosed
US-20040072859-A1 Urea substituted imidazoquinoline ethers 3M INNOVATIVE PROPERTIES COMPANY 2004-04-15 US disclosed
US-20040067975-A1 Amido ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2004-04-08 US disclosed
US-6677347-B2 ANTICARCINOGENIC AND ANTITUMOR AGENTS; VIRICIDED, IMMUNOMODULATORS 3M INNOVATIVE PROPERTIES COMPANY 2004-01-13 US disclosed
US-6664265-B2 Amido ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-12-16 US disclosed
US-6660735-B2 Inducing cytokine biosynthesis; viral diseases, neoplastic disorders 3M INNOVATIVE PROPERTIES COMPANY 2003-12-09 US disclosed
US-20030187016-A1 Amido ether substituted imidazoquinolines 3M INNOVATIVE PROPERTIES COMPANY 2003-10-02 US disclosed
US-20030139441-A1 Sulfonamido ether substituted imidazoquinolines UBS AG, STAMFORD BRANCH 2003-07-24 US disclosed
US-20030130518-A1 Urea substituted imidazoquinoline ethers COLEY PHARMACEUTICAL GROUP, INC. 2003-07-10 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 (9 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-20030187016-A1 Amido ether substituted imidazoquinolines IFNG, IRF3, EIF2AK2 TLR8 51/4885TLR7 14/4885NUDT1 792/4885
US-20080306252-A1 SULFONAMIDO ETHER SUBSTITUTED IMIDAZOQUINOLINES IFNG, IRF3, IL2 TLR8 50/4885TLR7 24/4885NUDT1 1582/4885
US-20040072859-A1 Urea substituted imidazoquinoline ethers IRF3, EIF2AK2, IFNG TLR8 273/4885TLR7 84/4885NUDT1 190/4885
US-20160222010-A1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS TLR4, TLR1, TLR5 TLR8 9/4885TLR7 4/4885NUDT1 2019/4885
US-20040067975-A1 Amido ether substituted imidazoquinolines IFNG, IRF3, EIF2AK2 TLR8 51/4885TLR7 14/4885NUDT1 792/4885
US-20030139441-A1 Sulfonamido ether substituted imidazoquinolines IFNG, IRF3, IL2 TLR8 50/4885TLR7 24/4885NUDT1 1582/4885
US-20030130518-A1 Urea substituted imidazoquinoline ethers IRF3, EIF2AK2, IFNG TLR8 273/4885TLR7 84/4885NUDT1 190/4885
US-20040097542-A1 Sulfonamido ether substituted imidazoquinolines IFNG, IRF3, IL2 TLR8 50/4885TLR7 24/4885NUDT1 1582/4885
US-20150299194-A1 4-AMINO-IMIDAZOQUINOLINE COMPOUNDS TLR4, TLR1, TLR5 TLR8 9/4885TLR7 4/4885NUDT1 2019/4885

“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.