SCHEMBL985802

SCHEMBL985802

Fc1cccc(COc2cc[c]cc2Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.47
ERBB2 P04626 7/20 0.47
MAOB P27338 6/20 0.46
IDO1 P14902 2/20 0.45
AGXT P21549 2/20 0.45
LMNA P02545 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
ERBB3 P21860 1/20 0.43
ERBB4 Q15303 1/20 0.43
MRGPRX4 Q96LA9 1/20 0.43

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
SCHEMBL3321452 0.85 MAOB (0.48) MAOBIDO1AGXTLMNAL3MBTL1
SCHEMBL693190 0.85 MRGPRX4 (0.51) MAOBIDO1AGXTMRGPRX4
SCHEMBL5475735 0.83 MAOB (0.51) MAOBIDO1AGXTLMNAL3MBTL1
SCHEMBL17975674 0.82 ALDH1A1 (0.43) MAOBIDO1AGXT
SCHEMBL3324129 0.82 MAOB (0.54) EGFRMAOBIDO1AGXTLMNA
SCHEMBL1446254 0.82 HPGD (0.46) MAOBL3MBTL1MRGPRX4
SCHEMBL28102426 0.81 MRGPRX4 (0.67) MAOBMRGPRX4
SCHEMBL5263840 0.80 MEN1 (0.60) EGFRERBB2MAOBIDO1AGXT
SCHEMBL29434222 0.80 MEN1 (0.60) EGFRERBB2MAOBIDO1AGXT
SCHEMBL694220 0.79 NPC1 (0.49) IDO1MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112759583-B Quinoline derivative containing furyl and preparation method and application thereof 河南省医药科学研究院 2022-10-11 CN claimed
CN-112694439-B Phenyl acrylamide quinoline derivative and preparation method and application thereof 河南省医药科学研究院 2022-08-30 CN claimed
CN-112759583-A Quinoline derivative containing furyl and preparation method and application thereof 河南省医药科学研究院 2021-05-07 CN claimed
CN-112694439-A Phenyl acrylamide quinoline derivative and preparation method and application thereof 河南省医药科学研究院 2021-04-23 CN claimed
CN-112625025-A Pyridyl substituted quinoline derivative and its prepn and use 河南省医药科学研究院 2021-04-09 CN claimed
CN-106892898-B Azasugar-derived quinazolines 陕西师范大学 2021-02-05 CN claimed
CN-107674059-B Benzaheteroaromatic ring compound and preparation method and application thereof 中国药科大学 2020-04-14 CN claimed
EP-3089961-B1 PROCESS FOR THE MANUFACTURE OF (E)-4-N,N-DIALKYLAMINO CROTONIC ACID IN HX SALT FORM AND USE THEREOF FOR SYNTHESIS OF EGFR TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM INT (DE) 2018-07-11 EP claimed
EP-3089961-A1 PROCESS FOR THE MANUFACTURE OF (E)-4-N,N-DIALKYLAMINO CROTONIC ACID IN HX SALT FORM AND USE THEREOF FOR SYNTHESIS OF EGFR TYROSINE KINASE INHIBITORS Boehringer Ingelheim International GmbH (DE) 2016-11-09 EP claimed
US-9242965-B2 Process for the manufacture of (E)-4-N,N-dialkylamino crotonic acid in HX salt form and use thereof for synthesis of EGFR tyrosine kinase inhibitors BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-01-26 US claimed
EP-1460072-B1 Bicyclic heteroaromatic compounds as protein tyrosine kinase inhibitors GLAXO GROUP LTD (GB) 2006-04-05 EP claimed
US-20050182043-A1 Bicyclic heterocyclic compounds, pharmaceutical compositions containing these compounds, their use and process for preparing them BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2005-08-18 US claimed
US-6924285-B2 Bicyclic heterocyclic compounds, pharmaceutical compositions containing these compounds, their use and process for preparing them BOEHRINGER INGELHEIM PHARMA GMBH & CO. (DE) 2005-08-02 US claimed
US-20050130995-A1 Chlorinating quinazolin-4-one in solvent in presence of a base; then reacting with an amine compound UBE INDUSTRIES, LTD. (JP) 2005-06-16 US claimed
EP-1492536-A1 4-(N-PHENYLAMINO)-QUINAZOLINES / QUINOLINES AS TYROSINE KINASE INHIBITORS Boehringer Ingelheim Pharma GmbH & Co.KG (DE) 2005-01-05 EP claimed
EP-1481971-A1 PROCESS FOR PRODUCING 4-AMINOQUINAZOLINE COMPOUND Ube Industries, Ltd. (JP) 2004-12-01 EP claimed
EP-1460072-A1 Bicyclic heteroaromatic compounds as protein tyrosine kinase inhibitors GLAXO GROUP LIMITED (GB) 2004-09-22 EP claimed
EP-1454907-A1 Quninazoline and pyridopyrmidine derivatives Glaxo Group Limited (GB) 2004-09-08 EP claimed
US-20040048880-A1 Bicyclic heterocyclic compounds, pharmaceutical compositions containing these compounds, their use and process for preparing them BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2004-03-11 US claimed
WO-2003082290-A1 4-(N-PHENYLAMINO)-QUINAZOLINES / QUINOLINES AS TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2003-10-09 WO 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 (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-20050130995-A1 Chlorinating quinazolin-4-one in solvent in presence of a base; then reacting with an amine compound HRH4, HRH3, H1-4 EGFR 543/4885ERBB2 231/4885MAOB 462/4885
US-20050182043-A1 Bicyclic heterocyclic compounds, pharmaceutical compositions containing these compounds, their use and process for preparing them CYP11B2, CYP11B1, HPGD EGFR 1233/4885ERBB2 1107/4885MAOB 262/4885
US-20040048880-A1 Bicyclic heterocyclic compounds, pharmaceutical compositions containing these compounds, their use and process for preparing them CYP11B1, AR, CYP11B2 EGFR 221/4885ERBB2 163/4885MAOB 344/4885

“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.