SCHEMBL596209

SCHEMBL596209

CCCCCNc1ccnc(Cl)n1

nearest known ligand 0.59

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TLR8 Q9NR97 1/20 0.59
DNM2 P50570 4/20 0.56
HRH3 Q9Y5N1 4/20 0.46
NUDT1 P36639 1/20 0.44
HRH4 Q9H3N8 2/20 0.43
HCAR3 P49019 1/20 0.43
KMT2A Q03164 1/20 0.43
STK17A Q9UEE5 1/20 0.43
MERTK Q12866 1/20 0.40
KDM4E B2RXH2 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
KCNH3 Q9ULD8 1/20 0.40
CNR2 P34972 1/20 0.39

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
SCHEMBL11278962 0.98 DNM2 (0.58) TLR8DNM2HRH3NUDT1HRH4
SCHEMBL14619916 0.95 TLR8 (0.66) TLR8DNM2HRH3NUDT1HRH4
SCHEMBL16139312 0.88 TLR8 (0.51) TLR8DNM2HRH3NUDT1HRH4
SCHEMBL14907960 0.81 HRH3 (0.68) TLR8HRH3NUDT1HRH4STK17A
SCHEMBL11286031 0.81 NUDT1 (0.66) TLR8DNM2HRH3NUDT1HRH4
SCHEMBL1401613 0.81 DNM2 (0.78) TLR8DNM2HRH3NUDT1HRH4
SCHEMBL12330669 0.81 HRH3 (0.55) TLR8DNM2HRH3NUDT1HRH4
SCHEMBL32678680 0.81 HSD17B10 (0.50) TLR8HRH3NUDT1HRH4KMT2A
SCHEMBL32678687 0.81 HSD17B10 (0.50) TLR8HRH3NUDT1HRH4KMT2A
SCHEMBL1519145 0.80 TLR8 (0.42) TLR8HRH3NUDT1HRH4HCAR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112574177-B Pyrimidine derivatives and application thereof in preparing antitumor drugs 陕西师范大学 2023-01-31 CN disclosed
CN-112574177-A Pyrimidine derivatives and application thereof in preparing antitumor drugs 陕西师范大学 2021-03-30 CN disclosed
EP-2311825-B1 Pyrimidineamines as angiogenesis modulators NOVARTIS AG (CH) 2015-10-07 EP disclosed
US-20120277258-A1 Chemical Compounds LEO OSPREY LIMITED (JE) 2012-11-01 US disclosed
US-8114885-B2 Pazopanib hydrochloride and synthesis, chemical intermediates, and dosage forms thereof; anticancer; colon cancer, breast cancer GLAXOSMITHKLINE LLC (US) 2012-02-14 US disclosed
EP-2311825-A1 Pyrimidineamines as angiogenesis modulators GlaxoSmithKline LLC (US) 2011-04-20 EP disclosed
US-7858626-B2 Pyrimidineamines as angiogenesis modulators GLAXOSMITHKLINE LLC (US) 2010-12-28 US disclosed
US-20100105712-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2010-04-29 US disclosed
EP-1343782-B1 PYRIMIDINEAMINES AS ANGIOGENESIS MODULATORS SMITHKLINE BEECHAM CORP (US) 2009-05-06 EP disclosed
US-7459455-B2 Pyrimidine compounds SMITHKLINE BEECHAM CORPORATION (US) 2008-12-02 US disclosed
US-20070270427-A1 CHEMICAL COMPOUNDS NOVARTIS AG (CH) 2007-11-22 US disclosed
US-7262203-B2 Pyrimidineamines as angiogenesis modulators SMITHKLINE BEECHAM CORPORATION (US) 2007-08-28 US disclosed
US-20070015756-A1 Chemical compounds NOVARTIS AG (CH) 2007-01-18 US disclosed
US-7105530-B2 inhibitors of vascular endothelial growth factor receptor-2 kinase; pazopanib and salts; for proliferative retinopathy; anticancer SMITHKLINE BEECHAM CORPORATION (US) 2006-09-12 US disclosed
US-20050085637-A1 Antiproliferative agents; angiogenesis inhibitors SMITHKLINE BEECHAM CORPORATION 2005-04-21 US disclosed
US-20040242578-A1 Pyrimidineamines as angiogenesis modulators NOVARTIS AG (CH) 2004-12-02 US disclosed
EP-1472233-A1 PYRIMIDINE COMPOUNDS SmithKline Beecham Corporation (US) 2004-11-03 EP disclosed
EP-1343782-A1 PYRIMIDINEAMINES AS ANGIOGENESIS MODULATORS GLAXO GROUP LIMITED (GB) 2003-09-17 EP disclosed
WO-2003066601-A1 PYRIMIDINE COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2003-08-14 WO disclosed
WO-2002059110-A1 PYRIMIDINEAMINES AS ANGIOGENESIS MODULATORS GLAXO GROUP LIMITED (GB) 2002-08-01 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 (6 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-20040242578-A1 Pyrimidineamines as angiogenesis modulators TYMS, TYMP, DPYD TLR8 3337/4885DNM2 1711/4885HRH3 294/4885
US-20070015756-A1 Chemical compounds KDR, FLT4, FLT1 TLR8 3246/4885DNM2 948/4885HRH3 853/4885
US-20100105712-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 TLR8 3246/4885DNM2 948/4885HRH3 853/4885
US-20120277258-A1 Chemical Compounds KDR, FLT4, FLT1 TLR8 3246/4885DNM2 948/4885HRH3 853/4885
US-20070270427-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 TLR8 3246/4885DNM2 948/4885HRH3 853/4885
US-20050085637-A1 Antiproliferative agents; angiogenesis inhibitors TIE1, TEK, KDR TLR8 3173/4885DNM2 207/4885HRH3 1404/4885

“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.