SCHEMBL4353760

SCHEMBL4353760

CC(C)CCNc1ncnc2ccc(-c3ccc(C#N)cc3)cc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 2/20 0.54
CDK8 P49336 2/20 0.54
CDKN1A P38936 1/20 0.54
CDK19 Q9BWU1 1/20 0.54
MAP4K4 O95819 3/20 0.53
CYP1A2 P05177 10/20 0.53
CYP3A4 P08684 9/20 0.53
HSD17B10 Q99714 8/20 0.53
ALDH1A1 P00352 8/20 0.53
CLK4 Q9HAZ1 7/20 0.53
USP2 O75604 5/20 0.53
CYP2C9 P11712 5/20 0.53
CYP2D6 P10635 5/20 0.53
LMNA P02545 4/20 0.53
TSHR P16473 4/20 0.53
MAPK1 P28482 4/20 0.53
HIF1A Q16665 4/20 0.53
TP53 P04637 3/20 0.53
RECQL P46063 2/20 0.53
KDM4E B2RXH2 2/20 0.52

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
SCHEMBL4353717 0.90 CYP1A2 (0.67) CCNCCDK8CDKN1ACDK19MAP4K4
SCHEMBL18041188 0.87 CLK4 (0.48) CCNCCDK8MAP4K4CYP1A2CYP3A4
SCHEMBL4355900 0.85 MAP4K4 (0.60) MAP4K4CYP1A2CYP3A4HSD17B10ALDH1A1
SCHEMBL4355612 0.85 CYP1A2 (0.49) CCNCCDK8CDKN1ACDK19MAP4K4
SCHEMBL4351915 0.84 MAP4K4 (0.53) CCNCCDK8MAP4K4CYP1A2CYP3A4
SCHEMBL31003507 0.84 MAP4K4 (0.53) CCNCCDK8MAP4K4CYP1A2CYP3A4
SCHEMBL4359000 0.84 MAP4K4 (0.56) CCNCCDK8MAP4K4CYP1A2CYP3A4
SCHEMBL4360601 0.84 MAP4K4 (0.56) CCNCCDK8MAP4K4CYP1A2CYP3A4
SCHEMBL4361135 0.84 MAP4K4 (0.62) MAP4K4CYP1A2CYP3A4HSD17B10ALDH1A1
SCHEMBL4359538 0.84 MEN1 (0.53) CCNCCDK8MAP4K4CYP1A2CYP3A4

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 CCNC 1372/4885CDK8 781/4885CDKN1A 2909/4885
US-20210276988-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR4A1 CCNC 1372/4885CDK8 781/4885CDKN1A 2909/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 CCNC 1318/4885CDK8 520/4885CDKN1A 2810/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 CCNC 1191/4885CDK8 441/4885CDKN1A 2578/4885
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR5A2 CCNC 1191/4885CDK8 441/4885CDKN1A 2578/4885

“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.