SCHEMBL4140835

SCHEMBL4140835

CC(=O)CC(C)(C)Cn1c(C)nc2c(N)nc3ccccc3c21

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 19/20 0.59
TLR8 Q9NR97 9/20 0.50
NUDT1 P36639 1/20 0.49

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
SCHEMBL22776975 0.89 TLR7 (0.59) TLR7TLR8NUDT1
SCHEMBL29507327 0.89 TLR7 (0.59) TLR7TLR8NUDT1
SCHEMBL483359 0.85 TLR7 (0.65) TLR7TLR8NUDT1
SCHEMBL30346049 0.85 TLR7 (0.65) TLR7TLR8NUDT1
SCHEMBL23139341 0.85 TLR7 (0.41) TLR7TLR8NUDT1
SCHEMBL5618099 0.84 TLR7 (0.54) TLR7TLR8NUDT1
SCHEMBL5618075 0.84 TLR7 (0.54) TLR7TLR8NUDT1
SCHEMBL5617015 0.84 TLR7 (0.61) TLR7TLR8NUDT1
SCHEMBL964316 0.83 TLR7 (0.68) TLR7TLR8NUDT1
SCHEMBL29395659 0.83 TLR7 (0.68) TLR7TLR8NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2018053508-A1 METHODS AND COMPOSITIONS FOR INDUCING AN IMMUNE RESPONSE THE UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2018-03-22 WO claimed
US-9765071-B2 Substituted imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY (US) 2017-09-19 US claimed
US-20160194322-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2016-07-07 US claimed
EP-1687307-B1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES CO (US) 2016-01-06 EP claimed
US-20140194628-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2014-07-10 US claimed
US-20240285645-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2024-08-29 US disclosed
EP-4140485-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV Gilead Sciences, Inc. (US) 2023-03-01 EP disclosed
EP-3166607-B1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES INC (US) 2022-08-31 EP disclosed
US-20220251212-A1 ANTI-PD-L1 COMBINATIONS FOR TREATING TUMORS BIRDIE BIOPHARMACEUTICALS INC (KY) 2022-08-11 US disclosed
US-20220204641-A1 ANTI-CD20 COMBINATIONS FOR TREATING TUMORS BIRDIE BIOPHARMACEUTICALS, INC. (KY) 2022-06-30 US disclosed
US-20220175762-A1 IMMUNE MODULATORY COMPOSITIONS AND METHODS FOR TREATING CANCERS BIRDIE BIOPHARMACEUTICALS INC (KY) 2022-06-09 US disclosed
US-20220062293-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV GILEAD SCIENCES, INC. 2022-03-03 US disclosed
US-20070099901-A1 Hydroxylamine and oxime substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines 3M INNOVATIVE PROPERTIES COMPANY (US) 2007-05-03 US disclosed
US-20070072893-A1 Substituted imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY 2007-03-29 US disclosed
US-20070072893-A1 Substituted imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY 2007-03-29 US disclosed
US-20070072893-A1 Substituted imidazo ring systems and methods 3M INNOVATIVE PROPERTIES COMPANY 2007-03-29 US disclosed
EP-1687307-A2 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M Innovative Properties Company (US) 2006-08-09 EP disclosed
EP-1686992-A2 HYDROXYLAMINE AND OXIME SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZOPYRIDINES, AND IMIDAZONAPHTHYRIDINES 3M Innovative Properties Company (US) 2006-08-09 EP disclosed
WO-2005051324-A2 HYDROXYLAMINE AND OXIME SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZOPYRIDINES, AND IMIDAZONAPHTHYRIDINES 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-06-09 WO disclosed
WO-2005051317-A2 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS 3M INNOVATIVE PROPERTIES COMPANY (US) 2005-06-09 WO 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-20070072893-A1 Substituted imidazo ring systems and methods IL2, IRF3, EIF2AK2 TLR7 162/4885TLR8 131/4885NUDT1 1793/4885
US-20160194322-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS IL2, IRF3, EIF2AK2 TLR7 155/4885TLR8 137/4885NUDT1 1387/4885
US-20220175762-A1 IMMUNE MODULATORY COMPOSITIONS AND METHODS FOR TREATING CANCERS IFNG, CD47, CD74 TLR7 75/4885TLR8 61/4885NUDT1 3300/4885
US-20140194628-A1 SUBSTITUTED IMIDAZO RING SYSTEMS AND METHODS IL2, IRF3, EIF2AK2 TLR7 155/4885TLR8 137/4885NUDT1 1387/4885
US-20070099901-A1 Hydroxylamine and oxime substituted imidazoquinolines, imidazopyridines, and imidazonaphthyridines IFNG, IRF3, IDO1 TLR7 81/4885TLR8 184/4885NUDT1 56/4885
US-20220204641-A1 ANTI-CD20 COMBINATIONS FOR TREATING TUMORS CD209, CD68, CD47 TLR7 1058/4885TLR8 694/4885NUDT1 4485/4885
US-20220062293-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV TLR7, TLR3, TLR6 TLR7 1/4885TLR8 8/4885NUDT1 553/4885
US-20240285645-A1 MODULATORS OF TOLL-LIKE RECEPTORS FOR THE TREATMENT OF HIV TLR7, TLR3, TLR6 TLR7 1/4885TLR8 8/4885NUDT1 553/4885
US-20220251212-A1 ANTI-PD-L1 COMBINATIONS FOR TREATING TUMORS PDCD1LG2, CD274, PDCD1 TLR7 879/4885TLR8 585/4885NUDT1 3947/4885

“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.