SCHEMBL412104

SCHEMBL412104

CC#CC(=O)Nc1ccc2ncnc(Nc3cccc(Br)c3)c2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
EGFR P00533 20/20 1.00
ERBB2 P04626 16/20 1.00
ERBB4 Q15303 2/20 1.00
ABCG2 Q9UNQ0 1/20 1.00

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
SCHEMBL29350449 1.00 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL29350915 1.00 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL4662734 0.96 EGFR (0.92) EGFRERBB2ERBB4ABCG2
SCHEMBL30115314 0.89 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL2985038 0.88 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL30115332 0.88 EGFR (0.84) EGFRERBB2ERBB4ABCG2
SCHEMBL7208931 0.88 EGFR (0.78) EGFRERBB2ERBB4ABCG2
SCHEMBL30115348 0.87 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL30115365 0.87 EGFR (1.00) EGFRERBB2ERBB4ABCG2
SCHEMBL12012727 0.87 EGFR (1.00) EGFRERBB2ERBB4ABCG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2207805-B1 NLRR-1 ANTAGONISTS AND USES THEREOF GENENTECH INC (US) 2014-07-09 EP claimed
EP-1553950-B1 THERAPEUTIC TREATMENT ASTRAZENECA AB (SE) 2007-08-08 EP claimed
EP-1202746-B1 NSAID AND EGFR KINASE INHIBITOR CONTAINING COMPOSITION FOR THE TREATMENT OR INHIBITION OF COLONIC POLYPS AND COLORECTAL CANCER WYETH CORP (US) 2006-10-04 EP claimed
US-20060122180-A1 Therapeutic treatment BOYLE FRANCIS T 2006-06-08 US claimed
EP-1553950-A1 THERAPEUTIC TREATMENT Astrazeneca AB (SE) 2005-07-20 EP claimed
WO-2004035057-A1 THERAPEUTIC TREATMENT ASTRAZENECA AB (SE) 2004-04-29 WO claimed
US-20030229051-A1 Irreversible inhibitors of tyrosine kinases BRIDGES ALEXANDER JAMES (US) 2003-12-11 US claimed
EP-0980244-B1 USE OF QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF POLYCYSTIC KIDNEY DISEASE WYETH CORP (US) 2003-06-04 EP claimed
EP-1202746-A1 NSAID AND EFGR KINASE INHIBITOR CONTAINING COMPOSITION FOR THE TREATMENT OR INHIBITION OF COLONIC POLYPS AND COLORECTAL CANCER American Cyanamid Company (US) 2002-05-08 EP claimed
EP-0892789-B1 IRREVERSIBLE INHIBITORS OF TYROSINE KINASES WARNER LAMBERT CO (US) 2002-02-27 EP claimed
WO-2001012227-A1 NSAID AND EFGR KINASE INHIBITOR CONTAINING COMPOSITION FOR THE TREATMENT OR INHIBITION OF COLONIC POLYPS AND COLORECTAL CANCER AMERICAN CYANAMID COMPANY (US) 2001-02-22 WO claimed
EP-1039910-A1 USE OF QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS FOR TREATING COLONIC POLYPS American Cyanamid Company (US) 2000-10-04 EP claimed
EP-0980244-A1 USE OF QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF POLYCYSTIC KIDNEY DISEASE American Cyanamid Company (US) 2000-02-23 EP claimed
US-5929080-A ADMINISTERING PHENYLAMINOQUINAZOLINE DERIVATIVE AMERICAN CYANAMID COMPANY (US) 1999-07-27 US claimed
WO-1999024037-A1 USE OF QUINAZOLINE DERIVATIVES AS TYROSINE KINASE INHIBITORS FOR TREATING COLONIC POLYPS AMERICAN CYANAMID COMPANY (US) 1999-05-20 WO claimed
EP-0892789-A1 IRREVERSIBLE INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1999-01-27 EP claimed
WO-1998050038-A1 USE OF QUINAZOLINE COMPOUNDS FOR THE TREATMENT OF POLYCYSTIC KIDNEY DISEASE AMERICAN CYANAMID COMPANY (US) 1998-11-12 WO claimed
US-5760041-A 4-aminoquinazoline EGFR Inhibitors AMERICAN CYANAMID COMPANY (US) 1998-06-02 US claimed
WO-1997038983-A1 IRREVERSIBLE INHIBITORS OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 1997-10-23 WO claimed
EP-0787722-A1 Substituted quinazoline derivatives American Cyanamid Company (US) 1997-08-06 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 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-20030229051-A1 Irreversible inhibitors of tyrosine kinases ERBB2, ERBB3, LCK EGFR 26/4885ERBB2 1/4885ERBB4 13/4885

“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.