SCHEMBL13620922

SCHEMBL13620922

Cc1cccc(Nc2ncnc3ccc(-c4ccc(F)cc4)cc23)c1

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 6/20 0.67
MAPK1 P28482 3/20 0.67
ERBB2 P04626 2/20 0.67
CD38 P28907 1/20 0.65
HIF1A Q16665 3/20 0.63
LMNA P02545 3/20 0.63
CYP1A2 P05177 3/20 0.63
CYP3A4 P08684 3/20 0.63
CYP2D6 P10635 3/20 0.63
CYP2C19 P33261 3/20 0.63
HTT P42858 2/20 0.63
MEN1 O00255 2/20 0.63
TSHR P16473 2/20 0.63
KMT2A Q03164 2/20 0.63
MAPT P10636 1/20 0.63
HPGD P15428 1/20 0.63
RAF1 P04049 4/20 0.61
BRAF P15056 4/20 0.61
KDM4E B2RXH2 1/20 0.59
USP2 O75604 2/20 0.58

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
SCHEMBL6187944 0.90 BRAF (0.73) EGFRMAPK1ERBB2CD38HIF1A
SCHEMBL8427296 0.90 EGFR (0.74) EGFRMAPK1ERBB2CD38HIF1A
Hydrochloric Acid SCHEMBL8427224 0.89 EGFR (0.72) EGFRMAPK1ERBB2CD38HIF1A
SCHEMBL4741375 0.85 EGFR (0.72) EGFRMAPK1ERBB2CD38HIF1A
SCHEMBL8871863 0.84 EGFR (0.82) EGFRMAPK1ERBB2CD38HIF1A
SCHEMBL5565226 0.82 HTT (0.72) EGFRMAPK1ERBB2CD38HIF1A
SCHEMBL13620920 0.82 MAPT (0.53) EGFRMAPK1ERBB2CD38HIF1A
SCHEMBL159209 0.81 EGFR (1.00) EGFRMAPK1ERBB2CD38HIF1A
SCHEMBL29350058 0.81 EGFR (1.00) EGFRMAPK1ERBB2CD38HIF1A
SCHEMBL4349199 0.81 MAPK1 (1.00) EGFRMAPK1ERBB2HIF1ACYP1A2

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-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-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-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
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 (4 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 EGFR 2581/4885MAPK1 2366/4885ERBB2 2249/4885
US-20090285782-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR5A2, NR4A1 EGFR 1831/4885MAPK1 2279/4885ERBB2 1669/4885
US-10882851-B2 4,6-di- and 2,4,6-trisubstituted quinazoline derivatives useful for treating viral infections NR3C1, NR3C2, NR5A2 EGFR 1826/4885MAPK1 2130/4885ERBB2 1782/4885
US-20160257673-A1 4,6-DI- AND 2,4,6-TRISUBSTITUTED QUINAZOLINE DERIVATIVES USEFUL FOR TREATING VIRAL INFECTIONS NR3C1, NR3C2, NR5A2 EGFR 1826/4885MAPK1 2130/4885ERBB2 1782/4885

“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.