SCHEMBL25241

SCHEMBL25241

O=[N+]([O-])c1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1F

nearest known ligand 0.63

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EGFR P00533 18/20 0.63
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
SCHEMBL29615011 1.00 EGFR (0.63) EGFRFBP1ERBB2AURKAINSR
SCHEMBL30237488 1.00 EGFR (0.63) EGFRFBP1ERBB2AURKAINSR
Hydrochloric Acid SCHEMBL4780920 0.99 EGFR (0.62) EGFRFBP1ERBB2AURKAINSR
SCHEMBL1366535 0.93 EGFR (0.68) EGFRFBP1ERBB2AURKAINSR
SCHEMBL30294136 0.93 EGFR (0.68) EGFRFBP1ERBB2AURKAINSR
Hydrochloric Acid SCHEMBL8314953 0.92 EGFR (0.67) EGFRFBP1ERBB2AURKAINSR
SCHEMBL28413582 0.91 EGFR (0.59) EGFRFBP1ERBB2AURKAINSR
SCHEMBL3246075 0.90 EGFR (0.61) EGFRFBP1ERBB2AURKAINSR
SCHEMBL18862887 0.90 EGFR (0.60) EGFRFBP1ERBB2AURKAINSR
SCHEMBL5097627 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 243 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113861120-A Preparation method of dacomitinib 湖南南新制药股份有限公司 2021-12-31 CN claimed
CN-111548314-B Production method of N- (3-chloro-4-fluorophenyl) -7-fluoro-6-nitro-4-quinazolinamine 上海万巷制药有限公司 2021-09-03 CN claimed
CN-109206377-B Novel method for preparing N- (3-chloro-4-fluorophenyl) -7-fluoro-6-nitro-4-quinazolinamine 江苏食品药品职业技术学院 2021-08-27 CN claimed
CN-111548314-A Production method of N- (3-chloro-4-fluorophenyl) -7-fluoro-6-nitro-4-quinazolinamine 上海万巷制药有限公司 2020-08-18 CN claimed
US-10550107-B2 Process for the preparation of N-[4-[(3-chloro-4-fluoro phenyl) amino]-7-[[(3s-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-4-(dimethyl amino)-(2E)-2-butenamide (2Z)-2-butenedioate (1:2) and its polymorphs thereof MSN LABORATORIES PRIVATE LIMITED (IN) 2020-02-04 US claimed
US-20180297989-A1 PROCESS FOR THE PREPARATION OF N-[4-[(3-CHLORO-4-FLUORO PHENYL) AMINO]-7-[[(3s-TETRAHYDRO-3-FURANYL]OXY]-6-QUINAZOLINYL]-4-(DIMETHYL AMINO)-(2E)-2-BUTENAMIDE (2Z)-2-BUTENEDIOATE (1 :2) AND ITS POLYMORPHS THEREOF MSN LABORATORIES PRIVATE LIMITED (IN) 2018-10-18 US claimed
US-20240382599-A1 EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE ARVINAS OPERATIONS, INC. 2024-11-21 US disclosed
CN-118063399-A Method for synthesizing N- (3-chloro-4-fluorophenyl) -6-hydroxy-7-methoxy-4-quinazolinamine 杭州微流汇科技有限公司 2024-05-24 CN disclosed
CN-117304170-A Bifunctional molecule capable of degrading EGFR mutant and preparation method and application thereof 中国药科大学 2023-12-29 CN disclosed
CN-115703817-A Bifunctional molecule for targeted degradation of EGFR mutant and preparation method and application thereof 中国药科大学 2023-02-17 CN disclosed
WO-2022184119-A1 TYROSINE KINASE INHIBITOR AND PHARMACEUTICAL USE THEREOF 江苏康可得生物技术股份有限公司 2022-09-09 WO disclosed
CN-114394942-A Tyrosine kinase inhibitor and pharmaceutical application thereof 江苏康可得生物技术股份有限公司 2022-04-26 CN disclosed
CN-113861120-A Preparation method of dacomitinib 湖南南新制药股份有限公司 2021-12-31 CN disclosed
EP-1131304-A1 N- 4-(3-CHLORO-4-FLUORO-PHENYLAMINO)-7-(3-MORPHOLIN-4-YL-PROPOXY)-QUINAZOLIN-6-YL]-ACRYLAMIDE, AN IRREVERSIBLE INHIBITOR OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 2001-09-12 EP disclosed
WO-2001036003-A2 SELECTIVE CELLULAR TARGETING: MULTIFUNCTIONAL DELIVERY VEHICLES DRUG INNOVATION & DESIGN, INC. (US) 2001-05-25 WO disclosed
EP-0635498-B1 Quinazoline derivatives and their use as anti-cancer agents SYNGENTA LTD (GB) 2001-04-18 EP disclosed
WO-2000031048-A1 N-[4-(3-CHLORO-4-FLUORO-PHENYLAMINO)-7-(3-MORPHOLIN-4-YL-PROPOXY)-QUINAZOLIN-6-YL]-ACRYLAMIDE, AN IRREVERSIBLE INHIBITOR OF TYROSINE KINASES WARNER-LAMBERT COMPANY (US) 2000-06-02 WO disclosed
US-5475001-A Quinazoline derivatives ZENECA LIMITED (GB) 1995-12-12 US disclosed
WO-1995003283-A1 QUINAZOLINE DERIVATIVES AND THEIR USE AS ANTI-CANCER AGENTS ZENECA LIMITED (GB) 1995-02-02 WO disclosed
EP-0635498-A1 Quinazoline derivatives and their use as anti-cancer agents ZENECA LIMITED (GB) 1995-01-25 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 (3 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-10550107-B2 Process for the preparation of N-[4-[(3-chloro-4-fluoro phenyl) amino]-7-[[(3s-tetrahydro-3-furanyl]oxy]-6-quinazolinyl]-4-(dimethyl amino)-(2E)-2-butenamide (2Z)-2-butenedioate (1:2) and its polymorphs thereof CYP4B1, CYP1B1, CYP2S1 EGFR 4240/4885FBP1 917/4885ERBB2 2343/4885
US-20180297989-A1 PROCESS FOR THE PREPARATION OF N-[4-[(3-CHLORO-4-FLUORO PHENYL) AMINO]-7-[[(3s-TETRAHYDRO-3-FURANYL]OXY]-6-QUINAZOLINYL]-4-(DIMETHYL AMINO)-(2E)-2-BUTENAMIDE (2Z)-2-BUTENEDIOATE (1 :2) AND ITS POLYMORPHS THEREOF CYP4B1, CYP1B1, CYP2S1 EGFR 4240/4885FBP1 917/4885ERBB2 2343/4885
US-20240382599-A1 EGFR PROTEOLYSIS TARGETING CHIMERIC MOLECULES AND ASSOCIATED METHODS OF USE TBK1, EGFR, CBL EGFR 2/4885FBP1 2591/4885ERBB2 6/4885

“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.