SCHEMBL4350168

SCHEMBL4350168

CC(C)(C)OC(=O)c1ccc2nc(N)nc(NC3CCCCC3)c2c1.O=C1C2CC=CCN12

nearest known ligand 0.35

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CSNK2A1 P68400 2/20 0.35
CSNK2A2 P19784 1/20 0.35
CSNK2B P67870 1/20 0.35
CNR1 P21554 1/20 0.35
NSD2 O96028 2/20 0.34
MERTK Q12866 1/20 0.34
EGLN1 Q9GZT9 4/20 0.34
ALOX15 P16050 1/20 0.34
CCR4 P51679 2/20 0.33
PDE5A O76074 2/20 0.33
ACP1 P24666 2/20 0.33
TLR7 Q9NYK1 1/20 0.32
ABCB1 P08183 1/20 0.32
ABCG2 Q9UNQ0 1/20 0.32
DNMT3A Q9Y6K1 1/20 0.32
IRAK4 Q9NWZ3 1/20 0.32
MEN1 O00255 1/20 0.31
HSP90AA1 P07900 1/20 0.31
KMT2A Q03164 1/20 0.31

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
SCHEMBL4355896 0.88 ABCG2 (0.34) ALOX15ABCB1ABCG2
SCHEMBL4356149 0.80 CYP1A2 (0.43) CSNK2A1CSNK2A2CSNK2BNSD2MERTK
SCHEMBL4349734 0.78 PDE5A (0.43) EGLN1PDE5AACP1ABCB1ABCG2
SCHEMBL4350165 0.78 NSD2 (0.40) CSNK2A1CSNK2A2CSNK2BCNR1NSD2
SCHEMBL4358577 0.78 ABCG2 (0.32) ABCB1ABCG2MEN1KMT2A
SCHEMBL4353838 0.72 PDE5A (0.41) NSD2MERTKEGLN1PDE5AACP1
SCHEMBL4103025 0.69 HPGDS (0.34) MEN1KMT2A
SCHEMBL4353291 0.69 HSP90AA1 (0.47) CNR1NSD2EGLN1DNMT3AIRAK4
SCHEMBL4362113 0.69 ROCK2 (0.45) NSD2EGLN1
SCHEMBL4362888 0.69 PIK3CA (0.49) CNR1NSD2EGLN1CCR4DNMT3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 claimed
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 claimed
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 claimed
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-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

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-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR4A1 CSNK2A1 2216/4885CSNK2A2 2416/4885CSNK2B 2171/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 CSNK2A1 1647/4885CSNK2A2 1881/4885CSNK2B 1749/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 CSNK2A1 1807/4885CSNK2A2 1965/4885CSNK2B 1922/4885

“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.