SCHEMBL2058751

SCHEMBL2058751

COCCOc1nc(N)c2ncn(Cc3cccc(CBr)c3)c2n1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 12/20 0.50
PDE4A P27815 1/20 0.46
PDE4B Q07343 1/20 0.46
PDE4C Q08493 1/20 0.46
PDE4D Q08499 1/20 0.46
NUDT1 P36639 1/20 0.45
ADORA2A P29274 1/20 0.43
PI4KA P42356 1/20 0.43
PI4K2B Q8TCG2 1/20 0.43
PI4K2A Q9BTU6 1/20 0.43
PI4KB Q9UBF8 1/20 0.43
PIK3CD O00329 2/20 0.43
YTHDC1 Q96MU7 1/20 0.42
PNP P00491 1/20 0.42

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
SCHEMBL3922033 0.90 YTHDC1 (0.53) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL12305136 0.87 TLR7 (0.53) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL509407 0.87 TLR7 (0.64) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL2058782 0.86 YTHDC1 (0.55) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL12305262 0.85 TLR7 (0.51) TLR7
SCHEMBL2060130 0.85 TLR7 (0.66) TLR7NUDT1ADORA2AYTHDC1PNP
SCHEMBL13728532 0.84 YTHDC1 (0.56) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL3923350 0.84 TLR7 (0.47) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL16481581 0.84 TLR7 (0.52) TLR7PDE4APDE4BPDE4CPDE4D
SCHEMBL3933232 0.83 YTHDC1 (0.61) TLR7NUDT1ADORA2AYTHDC1

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-9611268-B2 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. (US) 2017-04-04 US disclosed
US-9611268-B2 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. (US) 2017-04-04 US disclosed
US-9611268-B2 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. (US) 2017-04-04 US disclosed
US-20150239888-A1 MODULATORS OF TOLL-LIKE RECEPTOR 7 GILEAD SCIENCES, INC. 2015-08-27 US disclosed
US-20150239888-A1 MODULATORS OF TOLL-LIKE RECEPTOR 7 GILEAD SCIENCES, INC. 2015-08-27 US disclosed
US-20150239888-A1 MODULATORS OF TOLL-LIKE RECEPTOR 7 GILEAD SCIENCES, INC. 2015-08-27 US disclosed
EP-2170888-B1 PURINE DERIVATIVES AND THEIR USE AS MODULATORS OF TOLL-LIKE RECEPTOR 7 GILEAD SCIENCES INC (US) 2015-04-22 EP disclosed
US-8993755-B2 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. 2015-03-31 US disclosed
US-8993755-B2 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. 2015-03-31 US disclosed
US-8993755-B2 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. 2015-03-31 US disclosed
US-20110236348-A1 MODULATORS OF TOLL-LIKE RECEPTOR 7 GILEAD SCIENCES, INC. (US) 2011-09-29 US disclosed
US-7968544-B2 Agonists; Treatment of Hepatitis C virus; purine derivatives GILEAD SCIENCES, INC. (US) 2011-06-28 US disclosed
US-7968544-B2 Agonists; Treatment of Hepatitis C virus; purine derivatives GILEAD SCIENCES, INC. (US) 2011-06-28 US disclosed
US-7968544-B2 Agonists; Treatment of Hepatitis C virus; purine derivatives GILEAD SCIENCES, INC. (US) 2011-06-28 US disclosed
EP-2170888-A1 PURINE DERIVATIVES AND THEIR USE AS MODULATORS OF TOLL-LIKE RECEPTOR 7 Gilead Sciences, Inc. (US) 2010-04-07 EP disclosed
US-20090047249-A1 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. 2009-02-19 US disclosed
US-20090047249-A1 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. 2009-02-19 US disclosed
US-20090047249-A1 Modulators of toll-like receptor 7 GILEAD SCIENCES, INC. 2009-02-19 US disclosed
WO-2009005687-A1 PURINE DERIVATIVES AND THEIR USE AS MODULATORS OF TOLL-LIKE RECEPTOR 7 GILEAD SCIENCES, INC. (US) 2009-01-08 WO disclosed
WO-2009005687-A1 PURINE DERIVATIVES AND THEIR USE AS MODULATORS OF TOLL-LIKE RECEPTOR 7 GILEAD SCIENCES, INC. (US) 2009-01-08 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 (3 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-20090047249-A1 Modulators of toll-like receptor 7 TLR7, TLR6, TLR3 TLR7 1/4885PDE4A 1386/4885PDE4B 1552/4885
US-20110236348-A1 MODULATORS OF TOLL-LIKE RECEPTOR 7 TLR7, TLR6, TLR3 TLR7 1/4885PDE4A 1018/4885PDE4B 1212/4885
US-20150239888-A1 MODULATORS OF TOLL-LIKE RECEPTOR 7 TLR7, TLR6, TLR3 TLR7 1/4885PDE4A 1427/4885PDE4B 1548/4885

“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.