SCHEMBL2456578

SCHEMBL2456578

COc1cc2c(Nc3cccc(Cl)c3F)ncnc2cc1OC1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 13/20 0.78
ERBB2 P04626 10/20 0.73
RIPK2 O43353 2/20 0.72
RET P07949 2/20 0.72
EPHB2 P29323 2/20 0.72
EPHB4 P54760 2/20 0.72
EPHA4 P54764 2/20 0.72
RIPK3 Q9Y572 2/20 0.72
GAK O14976 1/20 0.72
LYN P07948 1/20 0.72
EPHA1 P21709 1/20 0.72
ERBB3 P21860 1/20 0.72
EPHA2 P29317 1/20 0.72
EPHA5 P54756 1/20 0.72
ADK P55263 1/20 0.72
PTK6 Q13882 1/20 0.72
MET P08581 1/20 0.65
TEC P42680 1/20 0.65
BTK Q06187 1/20 0.65
KCNH2 Q12809 1/20 0.65

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
SCHEMBL202067 1.00 EGFR (0.78) EGFRERBB2RIPK2RETEPHB2
SCHEMBL29781334 1.00 EGFR (0.78) EGFRERBB2RIPK2RETEPHB2
SCHEMBL5822843 0.96 EGFR (0.73) EGFRERBB2RIPK2RETEPHB2
SCHEMBL5821251 0.96 EGFR (0.72) EGFRERBB2RIPK2RETEPHB2
SCHEMBL3132903 0.96 EGFR (0.74) EGFRERBB2RIPK2RETEPHB2
SCHEMBL6436466 0.96 EGFR (0.74) EGFRERBB2RIPK2RETEPHB2
SCHEMBL3132783 0.96 EGFR (0.74) EGFRERBB2RIPK2RETEPHB2
SCHEMBL5210047 0.94 EGFR (0.85) EGFRERBB2RIPK2RETEPHB2
SCHEMBL3966911 0.92 EGFR (0.77) EGFRERBB2RIPK2RETEPHB2
SCHEMBL29781269 0.92 EGFR (0.77) EGFRERBB2RIPK2RETEPHB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110237610-A1 Quinazoline Derivatives as Antiproliferative Agents ASTRAZENECA AB (SE) 2011-09-29 US disclosed
US-7838530-B2 Quinazoline derivatives as antiproliferative agents ASTRAZENECA AB (SE) 2010-11-23 US disclosed
US-20090312343-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS HENNEQUIN LAURENT FRANCOIS AND 2009-12-17 US disclosed
US-7569577-B2 Quinazoline derivatives as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2009-08-04 US disclosed
EP-1667996-B1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2009-07-22 EP disclosed
EP-1667991-B1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2008-05-14 EP disclosed
US-20070043009-A1 Quinazoline derivatives as tyrosine kinase inhibitors ASTRAZENECA AB (SE) 2007-02-22 US disclosed
US-20070032513-A1 Quinazoline derivatives ASTRAZENECA AB (SE) 2007-02-08 US disclosed
US-20060287295-A1 Quinazoline derivatives as antiproliferative agents ASTRAZENECA AB (SE) 2006-12-21 US disclosed
EP-1667996-A1 QUINAZOLINE DERIVATIVES Astrazeneca AB (SE) 2006-06-14 EP disclosed
EP-1667991-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS Astrazeneca AB (SE) 2006-06-14 EP disclosed
EP-1668006-A1 QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS AstraZeneca AB (SE) 2006-06-14 EP disclosed
WO-2005030765-A1 QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2005-04-07 WO disclosed
WO-2005026150-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ASTRAZENECA AB (SE) 2005-03-24 WO disclosed
WO-2005026157-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2005-03-24 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-20090312343-A1 QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS ERBB2, ABL1, EGFR EGFR 3/4885ERBB2 1/4885RIPK2 1068/4885
US-20060287295-A1 Quinazoline derivatives as antiproliferative agents MKI67, CCNI, ERBB2 EGFR 5/4885ERBB2 3/4885RIPK2 1384/4885
US-20110237610-A1 Quinazoline Derivatives as Antiproliferative Agents ERBB2, EGFR, MKI67 EGFR 2/4885ERBB2 1/4885RIPK2 1386/4885
US-20070032513-A1 Quinazoline derivatives ERBB2, EGFR, ABL1 EGFR 2/4885ERBB2 1/4885RIPK2 1719/4885
US-20070043009-A1 Quinazoline derivatives as tyrosine kinase inhibitors ERBB2, ABL1, EGFR EGFR 3/4885ERBB2 1/4885RIPK2 1016/4885

“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.