SCHEMBL723442

SCHEMBL723442

C=CC(=O)NCc1cccc(-c2cc3nccc(Oc4ccc(Oc5ccccc5)cc4)c3o2)c1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGFR P00533 8/20 0.44
BTK Q06187 7/20 0.44
MET P08581 1/20 0.38
ERBB2 P04626 1/20 0.37
TEC P42680 1/20 0.37
TXK P42681 1/20 0.37
BLK P51451 1/20 0.37
BMX P51813 1/20 0.37
JAK3 P52333 1/20 0.37
ERBB4 Q15303 1/20 0.37
CYSLTR1 Q9Y271 1/20 0.37
TGM2 P21980 1/20 0.36
MAPK14 Q16539 2/20 0.36
EPHX1 P07099 2/20 0.36
FFAR1 O14842 1/20 0.36

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
SCHEMBL723499 0.87 HTT (0.43) METCYSLTR1MAPK14EPHX1FFAR1
SCHEMBL21082374 0.85 EGFR (0.34) EGFRBTKMETERBB2TEC
SCHEMBL722213 0.85 BTK (0.59) EGFRBTKERBB2TECTXK
SCHEMBL724108 0.84 EGFR (0.47) EGFRBTK
SCHEMBL723785 0.83 BTK (0.56) EGFRBTKERBB2TECTXK
SCHEMBL721787 0.81 TGM2 (0.52) EGFRBTKERBB2TECTXK
SCHEMBL18869138 0.80 BTK (0.65) EGFRBTKJAK3FFAR1
SCHEMBL723014 0.79 EGFR (0.58) EGFRBTKJAK3TGM2
SCHEMBL723500 0.78 BTK (0.48) EGFRBTKERBB2TECTXK
SCHEMBL14165631 0.78 BTK (0.64) EGFRBTKMAPK14EPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609100-B1 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2015-06-24 EP claimed
EP-2609100-A2 FUROPYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP claimed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO claimed
US-20230100137-A1 METHODS OF TREATING AND PREVENTING ALLOANTIBODY DRIVEN CHRONIC GRAFT VERSUS HOST DISEASE PHARMACYCLICS LLC (US) 2023-03-30 US disclosed
US-11318138-B2 Methods for treating B cell proliferative disorders CORNELL UNIVERSITY (US) 2022-05-03 US disclosed
US-20210177854-A1 METHODS OF TREATING AND PREVENTING ALLOANTIBODY DRIVEN CHRONIC GRAFT VERSUS HOST DISEASE PHARMACYCLICS LLC 2021-06-17 US disclosed
US-20210145835-A1 METHODS FOR THE TREATMENT OF HER2 AMPLIFIED CANCER PHARMACYCLICS, INC. 2021-05-20 US disclosed
US-20210121463-A1 METHODS OF TREATING AND PREVENTING GRAFT VERSUS HOST DISEASE PHARMACYCLICS LLC (US) 2021-04-29 US disclosed
US-20200397895-A1 TREATMENT USING BRUTON'S TYROSINE KINASE INHIBITORS AND IMMUNOTHERAPY PHARMACYCLICS LLC (US) 2020-12-24 US disclosed
US-20200368235-A1 IBRUTINIB COMBINATION THERAPY PHARMACYCLICS LLC (US) 2020-11-26 US disclosed
US-10695350-B2 Methods of treating and preventing graft versus host disease PHARMACYCLICS LLC (US) 2020-06-30 US disclosed
US-20150044217-A1 METHODS FOR THE TREATMENT OF HER2 AMPLIFIED CANCER PHARMACYCLICS LLC 2015-02-12 US disclosed
US-20150044217-A1 METHODS FOR THE TREATMENT OF HER2 AMPLIFIED CANCER PHARMACYCLICS LLC 2015-02-12 US disclosed
US-20150038518-A1 METHODS FOR THE TREATMENT OF SOLID TUMORS PHARMACYCLICS LLC 2015-02-05 US disclosed
US-20150038518-A1 METHODS FOR THE TREATMENT OF SOLID TUMORS PHARMACYCLICS LLC 2015-02-05 US disclosed
WO-2014159745-A1 COMBINATIONS OF BRUTON'S TYROSINE KINASE INHIBITORS AND CYP3A4 INHIBITORS PHARMACYCLICS, INC. (US) 2014-10-02 WO disclosed
US-20130225569-A1 FUROPYRIDINE DERIVATIVES MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 2013-08-29 US disclosed
EP-2609100-A2 FUROPYRIDINE DERIVATIVES Merck Patent GmbH (DE) 2013-07-03 EP disclosed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 WO disclosed
WO-2012025187-A2 FUROPYRIDINE DERIVATIVES MERCK PATENT GMBH (DE) 2012-03-01 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 (11 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-20210121463-A1 METHODS OF TREATING AND PREVENTING GRAFT VERSUS HOST DISEASE BLK, DCK, CILK1 EGFR 2307/4885BTK 8/4885MET 2255/4885
US-20150038518-A1 METHODS FOR THE TREATMENT OF SOLID TUMORS HDAC1, HDAC4, HDAC2 EGFR 1866/4885BTK 1268/4885MET 1098/4885
US-11318138-B2 Methods for treating B cell proliferative disorders CDK4, BCL6, BCL6B EGFR 1336/4885BTK 4/4885MET 985/4885
US-10695350-B2 Methods of treating and preventing graft versus host disease BLK, DCK, CILK1 EGFR 2307/4885BTK 8/4885MET 2255/4885
US-20210145835-A1 METHODS FOR THE TREATMENT OF HER2 AMPLIFIED CANCER ERBB2, EGFR, ERBB3 EGFR 2/4885BTK 10/4885MET 12/4885
US-20210177854-A1 METHODS OF TREATING AND PREVENTING ALLOANTIBODY DRIVEN CHRONIC GRAFT VERSUS HOST DISEASE FCGR3B, BTK, IGLV6-57 EGFR 1605/4885BTK 2/4885MET 522/4885
US-20150044217-A1 METHODS FOR THE TREATMENT OF HER2 AMPLIFIED CANCER ERBB2, EGFR, ERBB3 EGFR 2/4885BTK 10/4885MET 12/4885
US-20130225569-A1 FUROPYRIDINE DERIVATIVES SYK, FCGRT, SSB EGFR 1317/4885BTK 4/4885MET 1482/4885
US-20230100137-A1 METHODS OF TREATING AND PREVENTING ALLOANTIBODY DRIVEN CHRONIC GRAFT VERSUS HOST DISEASE FCGR3B, BTK, IGLV6-57 EGFR 1605/4885BTK 2/4885MET 522/4885
US-20200397895-A1 TREATMENT USING BRUTON'S TYROSINE KINASE INHIBITORS AND IMMUNOTHERAPY BTK, LCK, LYN EGFR 544/4885BTK 1/4885MET 2479/4885
US-20200368235-A1 IBRUTINIB COMBINATION THERAPY BTK, SYK, LYN EGFR 679/4885BTK 1/4885MET 2126/4885

“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.