SCHEMBL4353350

SCHEMBL4353350

CC(C)CCNc1ncnc2ccc(-c3ccc(N4CCNCC4)nc3)cc12

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TLR9 Q9NR96 4/20 0.45
TLR8 Q9NR97 4/20 0.45
TLR7 Q9NYK1 4/20 0.45
CYP1A2 P05177 10/20 0.45
CYP3A4 P08684 9/20 0.45
KDM4E B2RXH2 2/20 0.45
CLK4 Q9HAZ1 7/20 0.44
CYP2D6 P10635 5/20 0.44
HSD17B10 Q99714 4/20 0.43
ALDH1A1 P00352 4/20 0.43
MEN1 O00255 1/20 0.43
LMNA P02545 1/20 0.43
KMT2A Q03164 1/20 0.43
HIF1A Q16665 1/20 0.43
CYP2C19 P33261 2/20 0.43
MAP4K4 O95819 1/20 0.43
MAPT P10636 1/20 0.43
HPGD P15428 1/20 0.43
CLK1 P49759 1/20 0.42
IL2 P60568 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
SCHEMBL4358140 0.89 ATM (0.48) TLR9TLR8TLR7CYP1A2CYP3A4
SCHEMBL4362798 0.89 TLR9 (0.46) TLR9TLR8TLR7CYP1A2CYP3A4
SCHEMBL4367553 0.87 CYP1A2 (0.47) CYP1A2CYP3A4KDM4ECLK4CYP2D6
SCHEMBL4367550 0.82 CYP1A2 (0.51) CYP1A2CYP3A4KDM4ECLK4CYP2D6
SCHEMBL4353089 0.80 CNR1 (0.43) LMNAMAP4K4MAPTPIK3CAPIK3CD
SCHEMBL4353593 0.79 CDK1 (0.51) CYP1A2CYP3A4KDM4ECLK4HSD17B10
SCHEMBL4359250 0.79 CCNC (0.51) CYP1A2CYP3A4KDM4ECLK4CYP2D6
SCHEMBL4354985 0.78 MAP4K4 (0.56) CYP1A2CYP3A4KDM4ECLK4CYP2D6
SCHEMBL4354834 0.78 CLK4 (0.50) CYP1A2CYP3A4KDM4ECLK4CYP2D6
SCHEMBL4355879 0.78 IRAK4 (0.53) CYP1A2CYP3A4KDM4ECLK4CYP2D6

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 9 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
WO-2008009078-A2 4,6-DL- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-01-24 WO 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
WO-2008009078-A2 4,6-DL- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS GILEAD SCIENCES, INC. (US) 2008-01-24 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 (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 TLR9 710/4885TLR8 282/4885TLR7 32/4885
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR4A1 TLR9 710/4885TLR8 282/4885TLR7 32/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 TLR9 571/4885TLR8 177/4885TLR7 36/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 TLR9 711/4885TLR8 196/4885TLR7 59/4885
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR5A2 TLR9 711/4885TLR8 196/4885TLR7 59/4885

“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.