SCHEMBL1366535

SCHEMBL1366535

O=[N+]([O-])c1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1Cl

nearest known ligand 0.68

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.68
FBP1 P09467 2/20 0.60
ERBB2 P04626 2/20 0.60
AURKA O14965 1/20 0.60
INSR P06213 1/20 0.60
PDGFRB P09619 1/20 0.60
FLT4 P35916 1/20 0.60
KDR P35968 1/20 0.60
CLK1 P49759 1/20 0.60
EPHB4 P54760 1/20 0.60
TEK Q02763 1/20 0.60
AURKB Q96GD4 1/20 0.60
GRM1 Q13255 1/20 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
SCHEMBL30294136 1.00 EGFR (0.68) EGFRFBP1ERBB2AURKAINSR
Hydrochloric Acid SCHEMBL8314953 0.99 EGFR (0.67) EGFRFBP1ERBB2AURKAINSR
SCHEMBL25241 0.93 EGFR (0.63) EGFRFBP1ERBB2AURKAINSR
SCHEMBL30237488 0.93 EGFR (0.63) EGFRFBP1ERBB2AURKAINSR
SCHEMBL29615011 0.93 EGFR (0.63) EGFRFBP1ERBB2AURKAINSR
Hydrochloric Acid SCHEMBL4780920 0.92 EGFR (0.62) EGFRFBP1ERBB2AURKAINSR
SCHEMBL20305667 0.90 EGFR (0.60) EGFRFBP1ERBB2AURKAINSR
SCHEMBL18862887 0.90 EGFR (0.60) EGFRFBP1ERBB2AURKAINSR
SCHEMBL3246075 0.90 EGFR (0.61) EGFRFBP1ERBB2AURKAINSR
SCHEMBL30113246 0.90 EGFR (0.61) EGFRFBP1ERBB2AURKAINSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107674059-B Benzaheteroaromatic ring compound and preparation method and application thereof 中国药科大学 2020-04-14 CN disclosed
CN-107216317-B Preparation method of afatinib intermediate 上海医药工业研究院 2020-04-07 CN disclosed
CN-103382182-A Phenylurea coupling quinazoline compound, and preparation method, pharmaceutical composition and pharmaceutical use thereof UNIV HEBEI MEDICAL 2013-11-06 CN disclosed
EP-1981863-B1 PROCESS FOR PREPARING AMINOCROTONYLAMINO-SUBSTITUTED QUINAZOLINE DERIVATIVES BOEHRINGER INGELHEIM INT (DE) 2012-10-10 EP disclosed
US-8188274-B2 Process for preparing aminocrotonylamino-substituted quinazoline derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-05-29 US disclosed
US-8067593-B2 Process for preparing aminocrotonylamino-substituted quinazoline derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-11-29 US disclosed
US-20110207929-A1 Process for preparing aminocrotonylamino-substituted quinazoline derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-25 US disclosed
US-20110207932-A1 Process for preparing aminocrotonylamino-substituted quinazoline derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-08-25 US disclosed
US-7960546-B2 Process for preparing aminocrotonylamino-substituted quinazoline derivatives BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-06-14 US disclosed
EP-1369418-B1 QUINAZOLINE DERIVATIVES MITSUBISHI TANABE PHARMA CORP (JP) 2010-07-28 EP disclosed
US-7294629-B2 Quinazoline derivatives MITSUBISHI PHARMA CORPORATION (JP) 2007-11-13 US disclosed
WO-2007085638-A1 PROCESS FOR PREPARING AMINOCROTONYLAMINO-SUBSTITUTED QUINAZOLINE DERIVATIVES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2007-08-02 WO disclosed
CN-1264824-C Quinazoline derivatives MITSUBISHI PHARMA CORP (JP) 2006-07-19 CN disclosed
US-20040116422-A1 Quinazoline derivatives MITSUBISHI PHARMA CORPORATION (JP) 2004-06-17 US disclosed
CN-1492860-A Quinazoline derivatives ������ҩ��ʽ���� 2004-04-28 CN disclosed
EP-1369418-A1 QUINAZOLINE DERIVATIVES Mitsubishi Pharma Corporation (JP) 2003-12-10 EP disclosed
US-5955464-A USE OF THE RECEPTOR TYROSINE KINASE INHIBITORY PROPERTIES OF THE COMPOUNDS IN THE TREATMENT OF PROLIFERATIVE DISEASE SUCH AS CANCER ZENECA LIMITED (GB) 1999-09-21 US disclosed
EP-0794953-B1 QUINAZOLINE DERIVATIVES ZENECA LTD (GB) 1999-05-06 EP disclosed
EP-0794953-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1997-09-17 EP disclosed
WO-1996016960-A1 QUINAZOLINE DERIVATIVES ZENECA LIMITED (GB) 1996-06-06 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 (2 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-20110207932-A1 Process for preparing aminocrotonylamino-substituted quinazoline derivatives EGFR, CNKSR1, ERBB2 EGFR 1/4885FBP1 2368/4885ERBB2 3/4885
US-20110207929-A1 Process for preparing aminocrotonylamino-substituted quinazoline derivatives EGFR, CNKSR1, ERBB2 EGFR 1/4885FBP1 2368/4885ERBB2 3/4885

“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.