SCHEMBL4354805

SCHEMBL4354805

CCCNc1ncnc2ccc(-c3ccc(OC)c(OC)c3)cc12

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CLK4 Q9HAZ1 10/20 0.64
CLK1 P49759 1/20 0.61
CCNC P24863 1/20 0.60
HTT P42858 1/20 0.60
CDK8 P49336 1/20 0.60
ALDH1A1 P00352 9/20 0.58
CYP1A2 P05177 9/20 0.58
CYP3A4 P08684 8/20 0.58
HSD17B10 Q99714 8/20 0.58
CYP2D6 P10635 7/20 0.58
CYP2C19 P33261 6/20 0.58
TSHR P16473 5/20 0.58
LMNA P02545 4/20 0.58
MAPK1 P28482 4/20 0.58
MEN1 O00255 3/20 0.58
KMT2A Q03164 3/20 0.58
STAT3 P40763 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
USP2 O75604 5/20 0.57
APP P05067 1/20 0.56

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
SCHEMBL4356845 0.93 CLK4 (0.62) CLK4CLK1CCNCHTTCDK8
SCHEMBL4355619 0.87 CLK4 (0.61) CLK4ALDH1A1CYP1A2CYP3A4HSD17B10
SCHEMBL8351408 0.83 MAPK1 (0.67) CLK1HTTALDH1A1LMNAMAPK1
SCHEMBL4355479 0.82 CLK4 (0.60) CLK4CLK1ALDH1A1CYP1A2CYP3A4
SCHEMBL1675360 0.81 CLK4 (0.57) CLK4HTTALDH1A1CYP1A2CYP3A4
SCHEMBL4349672 0.81 CLK1 (0.65) CLK4CLK1CCNCHTTCDK8
SCHEMBL4357480 0.81 CLK1 (0.65) CLK4CLK1CCNCHTTCDK8
SCHEMBL4358362 0.81 APP (0.57) CLK4ALDH1A1APP
SCHEMBL1675331 0.78 CLK4 (1.00) CLK4CLK1ALDH1A1CYP1A2CYP3A4
SCHEMBL1675084 0.78 MAPK1 (0.76) CLK4CLK1HTTALDH1A1CYP1A2

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2009-11-19 US claimed
US-12049461-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections GILEAD SCIENCES, INC. (US) 2024-07-30 US disclosed
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. 2021-09-09 US disclosed
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections GILEAD SCIENCES, INC. (US) 2021-01-05 US disclosed
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. 2016-09-08 US disclosed
US-9259426-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections GILEAD SCIENCES, INC. (US) 2016-02-16 US disclosed
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2009-11-19 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 (5 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-12049461-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR4A1 CLK4 957/4885CLK1 2890/4885CCNC 1372/4885
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR4A1 CLK4 957/4885CLK1 2890/4885CCNC 1372/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 CLK4 960/4885CLK1 2973/4885CCNC 1318/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 CLK4 1192/4885CLK1 3567/4885CCNC 1191/4885
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR5A2 CLK4 1192/4885CLK1 3567/4885CCNC 1191/4885

“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.