SCHEMBL2100447

SCHEMBL2100447

COc1cc2ncnc(Nc3ccc(Cl)c(Cl)c3)c2cc1OC

nearest known ligand 0.80

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ KDR P35968 18/20 0.80
▸ EPHB4 P54760 12/20 0.80
▸ ERBB2 P04626 5/20 0.80
▸ EGFR P00533 5/20 0.80
▸ CLK1 P49759 2/20 0.80
▸ AURKA O14965 1/20 0.80
▸ INSR P06213 1/20 0.80
▸ FBP1 P09467 1/20 0.80
▸ PDGFRB P09619 1/20 0.80
▸ FLT4 P35916 1/20 0.80
▸ TEK Q02763 1/20 0.80
▸ AURKB Q96GD4 1/20 0.80
▸ RET P07949 1/20 0.80
▸ KIF5B P33176 1/20 0.80
▸ EPHA2 P29317 14/20 0.78
▸ FLT1 P17948 3/20 0.76
▸ ABCG2 Q9UNQ0 1/20 0.76
▸ LCK P06239 1/20 0.74

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
SCHEMBL22590721 0.92 EGFR (0.80) KDREPHB4ERBB2EGFRCLK1
SCHEMBL22630825 0.90 KDR (0.77) KDREPHB4ERBB2EGFRCLK1
SCHEMBL907182 0.90 KDR (0.77) KDREPHB4ERBB2EGFRCLK1
SCHEMBL22630824 0.90 KDR (0.69) KDREPHB4ERBB2EGFRCLK1
SCHEMBL907124 0.90 KDR (0.72) KDREPHB4ERBB2EGFRCLK1
SCHEMBL907447 0.89 KDR (0.70) KDREPHB4ERBB2EGFRCLK1
Hydrochloric Acid SCHEMBL907176 0.89 KDR (0.71) KDREPHB4ERBB2EGFRCLK1
SCHEMBL2099106 0.89 EGFR (1.00) KDREPHB4ERBB2EGFRCLK1
SCHEMBL5864546 0.89 KDR (0.82) KDREPHB4ERBB2EGFRCLK1
SCHEMBL14095961 0.89 EGFR (0.80) KDREPHB4ERBB2EGFRCLK1

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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0566226-B1 Quinazoline derivatives ZENECA LTD (GB) 1995-11-08 — — EP claimed
US-5457105-A anticancer use; e.g. 4-(3'-chloro-4'-fluoroanilino)-6,7-dimethoxyquinazoline (gefitinib) ZENECA LIMITED (GB) 1995-10-10 — — US claimed
EP-0566226-A1 Quinazoline derivatives ZENECA LIMITED (GB) 1993-10-20 — — EP claimed
US-20160303127-A1 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS GENENTECH INC (US) 2016-10-20 — — US disclosed
US-20150086545-A1 COMBINATION THERAPY OF HER EXPRESSING TUMORS GENENTECH, INC. (US) 2015-03-26 — — US disclosed
US-20150056207-A1 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS GENENTECH INC (US) 2015-02-26 — — US disclosed
US-20120251530-A1 COMBINATION THERAPY OF HER EXPRESSING TUMORS SLIWKOWSKI MARK X (US) 2012-10-04 — — US disclosed
US-20120189573-A1 Methods of using death receptor agonists and EGFR inhibitors GENENTECH, INC. (US) 2012-07-26 — — US disclosed
US-8163287-B2 Combination therapy of her expressing tumors GENENTECH, INC. (US) 2012-04-24 — — US disclosed
US-20110262436-A1 TREATMENT METHOD GENENTECH, INC. (US) 2011-10-27 — — US disclosed
EP-2257293-A2 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS Genentech, Inc. (US) 2010-12-08 — — EP disclosed
US-20090155247-A1 Methods of Using Death Receptor Agonists and EGFR Inhibitors ASHKENAZI AVI J 2009-06-18 — — US disclosed
US-20080199480-A1 Methods for Identifying Risk of Type II Diabetes and Treatments Thereof SEQUENOM, INC. (US) 2008-08-21 — — US disclosed
US-20080199480-A1 Methods for Identifying Risk of Type II Diabetes and Treatments Thereof SEQUENOM, INC. (US) 2008-08-21 — — US disclosed
US-20070020261-A1 Combination therapy of her expressing tumors GENENTECH, INC. 2007-01-25 — — US disclosed
US-20060188498-A1 Methods of using death receptor agonists and EGFR inhibitors GENENTECH, INC. 2006-08-24 — — US disclosed
US-5616582-A Use as anticancer agents; e.g. gefitinib ZENECA LIMITED (GB) 1997-04-01 — — US disclosed
EP-0566226-B1 Quinazoline derivatives ZENECA LTD (GB) 1995-11-08 — — EP disclosed
US-5457105-A anticancer use; e.g. 4-(3'-chloro-4'-fluoroanilino)-6,7-dimethoxyquinazoline (gefitinib) ZENECA LIMITED (GB) 1995-10-10 — — US disclosed
EP-0566226-A1 Quinazoline derivatives ZENECA LIMITED (GB) 1993-10-20 — — EP 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 (10 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-20120189573-A1 Methods of using death receptor agonists and EGFR inhibitors EGFR, ERBB4, TNFRSF9 KDR 50/4885EPHB4 40/4885ERBB2 7/4885
US-20090155247-A1 Methods of Using Death Receptor Agonists and EGFR Inhibitors EGFR, ERBB4, TNFRSF9 KDR 50/4885EPHB4 40/4885ERBB2 7/4885
US-20150086545-A1 COMBINATION THERAPY OF HER EXPRESSING TUMORS ERBB2, EGFR, ERBB3 KDR 34/4885EPHB4 466/4885ERBB2 1/4885
US-20080199480-A1 Methods for Identifying Risk of Type II Diabetes and Treatments Thereof SLC5A2, GCKR, IAPP KDR 2859/4885EPHB4 1038/4885ERBB2 2284/4885
US-20060188498-A1 Methods of using death receptor agonists and EGFR inhibitors EGFR, ERBB4, TNFRSF9 KDR 50/4885EPHB4 40/4885ERBB2 7/4885
US-20070020261-A1 Combination therapy of her expressing tumors ERBB2, EGFR, ERBB3 KDR 34/4885EPHB4 466/4885ERBB2 1/4885
US-20160303127-A1 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS MET, EGFR, ERBB2 KDR 33/4885EPHB4 109/4885ERBB2 3/4885
US-20110262436-A1 TREATMENT METHOD HGF, HDGF, FGF2 KDR 424/4885EPHB4 1329/4885ERBB2 26/4885
US-20150056207-A1 COMBINATION THERAPY WITH C-MET AND EGFR ANTAGONISTS MET, EGFR, ERBB2 KDR 33/4885EPHB4 109/4885ERBB2 3/4885
US-20120251530-A1 COMBINATION THERAPY OF HER EXPRESSING TUMORS ERBB2, EGFR, ERBB3 KDR 34/4885EPHB4 466/4885ERBB2 1/4885

“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.

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