SCHEMBL5583941

SCHEMBL5583941

O=C(O)c1nc2nc(Nc3ccc(N4CCOCC4)cc3)ncc2cc1-c1c(Cl)cccc1Cl

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SRC P12931 4/20 0.63
FGFR1 P11362 3/20 0.63
PKMYT1 Q99640 3/20 0.63
SLC2A1 P11166 2/20 0.63
PDGFRB P09619 1/20 0.63
PDGFRA P16234 1/20 0.63
WEE1 P30291 3/20 0.53
FGFR2 P21802 1/20 0.53
FGFR4 P22455 1/20 0.53
FGFR3 P22607 1/20 0.53
BRD4 O60885 1/20 0.51
BTK Q06187 1/20 0.50
MAPK8 P45983 1/20 0.50
MAPK9 P45984 1/20 0.50
MAPK10 P53779 1/20 0.50
LCK P06239 1/20 0.49
HCK P08631 1/20 0.49
EGFR P00533 1/20 0.49
STAT6 P42226 2/20 0.49
INSR P06213 1/20 0.49

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
SCHEMBL5583949 0.92 SRC (0.62) SRCFGFR1PKMYT1SLC2A1PDGFRB
SCHEMBL5583963 0.90 SRC (0.66) SRCFGFR1PKMYT1SLC2A1PDGFRB
SCHEMBL14573081 0.85 WEE1 (0.56) SRCFGFR1PDGFRBPDGFRAWEE1
SCHEMBL3865248 0.84 CCND3 (0.52) SRCFGFR1PKMYT1SLC2A1PDGFRB
SCHEMBL4424151 0.84 IGF1R (0.56) SRCFGFR1PKMYT1SLC2A1PDGFRB
SCHEMBL5583797 0.83 SRC (0.62) SRCFGFR1PKMYT1SLC2A1PDGFRB
SCHEMBL3865121 0.82 STAT6 (0.53) SRCFGFR1PKMYT1SLC2A1PDGFRB
SCHEMBL5583960 0.79 FGFR1 (0.48) SRCFGFR1PDGFRBPDGFRAWEE1
SCHEMBL5583903 0.78 FGFR1 (0.55) SRCFGFR1PKMYT1SLC2A1PDGFRB
SCHEMBL3458816 0.78 SRC (1.00) SRCFGFR1PKMYT1SLC2A1PDGFRB

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2007529451-A 2007-10-25 JP claimed
US-7189732-B2 Pyrido[2,3-d]pyrimidine dichloro-phenyl derivatives HOFFMAN-LA ROCHE INC. (US) 2007-03-13 US claimed
EP-1727819-A1 NOVEL DICHLORO-PHENYL-PYRIDO¬2,3-D|PYRIMIDINE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2006-12-06 EP claimed
US-20060014765-A1 Dichloro-phenyl derivatives HOFFMANN-LA ROCHE INC. 2006-01-19 US claimed
WO-2005090344-A1 NOVEL DICHLORO-PHENYL-PYRIDO [2,3-D] PYRIMIDINE DERIVATES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-29 WO claimed
US-20210251944-A1 METHODS FOR TREATING A CANCER RESISTANT TO AT LEAST ONE TYROSINE KINASE INHIBITOR DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2021-08-19 US disclosed
CN-112755193-A Method of treating malignancies with anti-tyrosine kinase inhibitors using dianhydrogalactitol or a derivative thereof 德玛医药 2021-05-07 CN disclosed
EP-2872161-B1 DIANHYDROGALACTITOL FOR USE IN TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS DEL MAR PHARMACEUTICALS (CA) 2020-12-16 EP disclosed
US-20150182490-A1 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF DEL MAR PHARMACEUTICALS (BC) LTD. (CA) 2015-07-02 US disclosed
EP-2872161-A2 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF Del Mar Pharmaceuticals (CA) 2015-05-20 EP disclosed
WO-2014004376-A2 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF DEL MAR PHARMACEUTICALS (CA) 2014-01-03 WO disclosed
US-7189732-B2 Pyrido[2,3-d]pyrimidine dichloro-phenyl derivatives HOFFMAN-LA ROCHE INC. (US) 2007-03-13 US disclosed
EP-1727819-A1 NOVEL DICHLORO-PHENYL-PYRIDO¬2,3-D|PYRIMIDINE DERIVATIVES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F.HOFFMANN-LA ROCHE AG (CH) 2006-12-06 EP disclosed
US-20060014765-A1 Dichloro-phenyl derivatives HOFFMANN-LA ROCHE INC. 2006-01-19 US disclosed
WO-2005090344-A1 NOVEL DICHLORO-PHENYL-PYRIDO [2,3-D] PYRIMIDINE DERIVATES, THEIR MANUFACTURE AND USE AS PHARMACEUTICAL AGENTS F. HOFFMANN-LA ROCHE AG (CH) 2005-09-29 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 (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-20150182490-A1 METHODS FOR TREATING TYROSINE-KINASE-INHIBITOR-RESISTANT MALIGNANCIES IN PATIENTS WITH GENETIC POLYMORPHISMS OR AHI1 DYSREGULATIONS OR MUTATIONS EMPLOYING DIANHYDROGALACTITOL, DIACETYLDIANHYDROGALACTITOL, DIBROMODULCITOL, OR ANALOGS OR DERIVATIVES THEREOF WHR1, AIPL1, TDP1 SRC 1484/4885FGFR1 482/4885PKMYT1 1886/4885
US-20210251944-A1 METHODS FOR TREATING A CANCER RESISTANT TO AT LEAST ONE TYROSINE KINASE INHIBITOR DCLRE1B, AIPL1, WHR1 SRC 1586/4885FGFR1 358/4885PKMYT1 2972/4885
US-20060014765-A1 Dichloro-phenyl derivatives SRC, ABL1, LCK SRC 1/4885FGFR1 145/4885PKMYT1 460/4885

“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.