SCHEMBL4356115

SCHEMBL4356115

Fc1ccc(-c2ccc3nc(-c4ccn[nH]4)nc(NC4CC4)c3c2)cc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHEK1 O14757 2/20 0.47
CHEK2 O96017 2/20 0.47
GABBR2 O75899 1/20 0.44
GABBR1 Q9UBS5 1/20 0.44
ACP1 P24666 2/20 0.43
NLRP3 Q96P20 1/20 0.43
JAK2 O60674 1/20 0.43
EGLN1 Q9GZT9 1/20 0.42
NPR1 P16066 3/20 0.42
GBA1 P04062 1/20 0.41
IRAK4 Q9NWZ3 3/20 0.41
LATS1 O95835 1/20 0.40
LATS2 Q9NRM7 1/20 0.40
USP2 O75604 3/20 0.40
CYP1A2 P05177 3/20 0.40
CYP3A4 P08684 3/20 0.40
CLK4 Q9HAZ1 3/20 0.40
HSD17B10 Q99714 2/20 0.40
LMNA P02545 1/20 0.40
MAPK1 P28482 1/20 0.40

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
SCHEMBL18041181 0.87 CHEK1 (0.42) CHEK1CHEK2GABBR2GABBR1ACP1
SCHEMBL4780898 0.84 NPR1 (0.43) CHEK1CHEK2EGLN1NPR1IRAK4
SCHEMBL4367767 0.78 JAK2 (0.45) GABBR2GABBR1ACP1JAK2EGLN1
SCHEMBL4363691 0.77 GABBR2 (0.50) GABBR2GABBR1ACP1JAK2EGLN1
SCHEMBL4352010 0.77 GABBR2 (0.68) GABBR2GABBR1ACP1JAK2EGLN1
SCHEMBL4353731 0.73 GABBR2 (0.48) GABBR2GABBR1ACP1JAK2EGLN1
SCHEMBL4358023 0.72 GABBR2 (0.47) GABBR2GABBR1ACP1JAK2NPR1
SCHEMBL4354726 0.72 CYP1A2 (0.70) IRAK4USP2CYP1A2CYP3A4CLK4
SCHEMBL4349736 0.71 NPR1 (0.56) NPR1
SCHEMBL1084363 0.69 MEN1 (0.67) CHEK1CHEK2GBA1USP2CYP1A2

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 8 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
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 CHEK1 4493/4885CHEK2 4614/4885GABBR2 1751/4885
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR4A1 CHEK1 4493/4885CHEK2 4614/4885GABBR2 1751/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 CHEK1 4257/4885CHEK2 4444/4885GABBR2 1364/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 CHEK1 4230/4885CHEK2 4471/4885GABBR2 1228/4885
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR5A2 CHEK1 4230/4885CHEK2 4471/4885GABBR2 1228/4885

“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.