SCHEMBL2131741

SCHEMBL2131741

C#Cc1cccc(Nc2c(C#N)cnc3cc(OCC)c(N)cc23)c1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.72
GAK O14976 2/20 0.72
ERBB2 P04626 12/20 0.69
STK4 Q13043 4/20 0.56
FBP1 P09467 1/20 0.55
SRC P12931 1/20 0.52

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
SCHEMBL30132269 1.00 EGFR (0.72) EGFRGAKERBB2STK4FBP1
SCHEMBL29670932 1.00 EGFR (0.72) EGFRGAKERBB2STK4FBP1
SCHEMBL22419601 0.94 EGFR (0.71) EGFRGAKERBB2STK4SRC
SCHEMBL2943166 0.90 EGFR (0.85) EGFRGAKERBB2SRC
SCHEMBL3593063 0.90 EGFR (0.86) EGFRGAKERBB2SRC
SCHEMBL20584416 0.87 EGFR (0.71) EGFRGAKERBB2STK4SRC
SCHEMBL1897571 0.87 EGFR (0.85) EGFRGAKERBB2STK4
SCHEMBL29670935 0.85 EGFR (0.67) EGFRGAKERBB2STK4
SCHEMBL28487491 0.85 EGFR (0.67) EGFRGAKERBB2STK4
SCHEMBL14855133 0.84 EGFR (0.66) EGFRGAKERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115490636-A Heterocyclic compound and preparation method and application thereof 苏中药业集团股份有限公司 2022-12-20 CN claimed
CN-111875539-B Preparation method of EGFR (epidermal growth factor receptor) molecular targeted antitumor drug 苏中药业集团股份有限公司 2022-06-21 CN claimed
CN-111875539-A Preparation method of EGFR (epidermal growth factor receptor) molecular targeted antitumor drug 江苏苏中药业集团股份有限公司 2020-11-03 CN claimed
US-20090105247-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2009-04-23 US claimed
US-12017996-B2 Substituted quinolines and formulations thereof JIANGSU MEDOLUTION LTD (CN) 2024-06-25 US disclosed
CN-116135844-A Heterocyclic compound and preparation method and application thereof 苏中药业集团股份有限公司 2023-05-19 CN disclosed
CN-115490636-A Heterocyclic compound and preparation method and application thereof 苏中药业集团股份有限公司 2022-12-20 CN disclosed
CN-115490636-A Heterocyclic compound and preparation method and application thereof 苏中药业集团股份有限公司 2022-12-20 CN disclosed
US-20220371999-A1 SUBSTITUTED QUINOLINES AND FORMULATIONS THEREOF JIANGSU MEDOLUTION LTD (CN) 2022-11-24 US disclosed
CN-111875539-B Preparation method of EGFR (epidermal growth factor receptor) molecular targeted antitumor drug 苏中药业集团股份有限公司 2022-06-21 CN disclosed
CN-111875539-A Preparation method of EGFR (epidermal growth factor receptor) molecular targeted antitumor drug 江苏苏中药业集团股份有限公司 2020-11-03 CN disclosed
US-8765946-B2 Methods of preparing and using quinazoline and quinoline derivatives TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2014-07-01 US disclosed
US-20100240649-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2010-09-23 US disclosed
US-20100240649-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2010-09-23 US disclosed
US-20100240649-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2010-09-23 US disclosed
US-7754729-B2 Quinazoline and quinoline derivatives as irreversible protein tyrosine kinase inhibitors TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2010-07-13 US disclosed
US-20090105247-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2009-04-23 US disclosed
US-20090105247-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2009-04-23 US disclosed
US-20090105247-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS TIANJIN HEMAY ONCOLOGY PHARMACEUTICAL CO., LTD. (CN) 2009-04-23 US disclosed
EP-2045245-A1 INREVERSIBLE PROTEIN TYROSINE KINASES INHIBITORS AND THE PREPARATION METHODS AND USES THEREOF Tian Jin Hemay Bio-Tech Co., Ltd. (CN) 2009-04-08 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 (4 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-12017996-B2 Substituted quinolines and formulations thereof MAP3K20, ABL1, MAP3K10 EGFR 1594/4885GAK 308/4885ERBB2 307/4885
US-20220371999-A1 SUBSTITUTED QUINOLINES AND FORMULATIONS THEREOF MAP3K20, ABL1, MAP3K10 EGFR 1594/4885GAK 308/4885ERBB2 307/4885
US-20090105247-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS ABL1, MAP3K7, MAP3K5 EGFR 621/4885GAK 390/4885ERBB2 170/4885
US-20100240649-A1 QUINAZOLINE AND QUINOLINE DERIVATIVES AS IRREVERSIBLE PROTEIN TYROSINE KINASE INHIBITORS ABL1, MAP3K7, MAP3K5 EGFR 621/4885GAK 390/4885ERBB2 170/4885

“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.