SCHEMBL589389

SCHEMBL589389

Cc1n[nH]c2cc(Nc3ccnc(Cl)n3)ccc12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPKAPK2 P49137 6/20 0.42
GRM4 Q14833 5/20 0.42
KDR P35968 4/20 0.40
BRD4 O60885 1/20 0.40
MAPK10 P53779 2/20 0.38
MAPK14 Q16539 2/20 0.38
MAPK8 P45983 1/20 0.38
AURKA O14965 1/20 0.38
AURKB Q96GD4 1/20 0.38
TRPA1 O75762 1/20 0.37
TERT O14746 1/20 0.37
DOT1L Q8TEK3 1/20 0.37

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
SCHEMBL20611795 0.90 MAPKAPK2 (0.50) MAPKAPK2GRM4KDR
SCHEMBL12776139 0.80 KDR (0.60) MAPKAPK2KDRBRD4MAPK8TERT
SCHEMBL12325164 0.77 FADS1 (0.43) GRM4TRPA1
SCHEMBL589329 0.77 TRPA1 (0.48) GRM4AURKATRPA1
SCHEMBL12612817 0.76 ROCK2 (0.55) MAPKAPK2KDRAURKAAURKBTERT
Gw612286X SCHEMBL21067484 0.76 KDR (0.72) KDRBRD4AURKAAURKB
SCHEMBL6979830 0.75 ALDH1A1 (0.50) MAPKAPK2KDRTERTDOT1L
SCHEMBL13485393 0.75 KDM4E (0.44) KDRMAPK14TERTDOT1L
SCHEMBL2598750 0.74 MEN1 (0.43) MAPKAPK2KDRTERTDOT1L
SCHEMBL4488694 0.74 SCN9A (0.49) AURKATERTDOT1L

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-20120277258-A1 Chemical Compounds LEO OSPREY LIMITED (JE) 2012-11-01 US 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
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
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-7858626-B2 Pyrimidineamines as angiogenesis modulators GLAXOSMITHKLINE LLC (US) 2010-12-28 US disclosed
US-20070270427-A1 CHEMICAL COMPOUNDS NOVARTIS AG (CH) 2007-11-22 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-7262203-B2 Pyrimidineamines as angiogenesis modulators SMITHKLINE BEECHAM CORPORATION (US) 2007-08-28 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-20070015756-A1 Chemical compounds NOVARTIS AG (CH) 2007-01-18 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-20040242578-A1 Pyrimidineamines as angiogenesis modulators NOVARTIS AG (CH) 2004-12-02 US 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-20040242578-A1 Pyrimidineamines as angiogenesis modulators TYMS, TYMP, DPYD MAPKAPK2 1555/4885GRM4 3534/4885KDR 5/4885
US-20070015756-A1 Chemical compounds KDR, FLT4, FLT1 MAPKAPK2 970/4885GRM4 4217/4885KDR 1/4885
US-20120277258-A1 Chemical Compounds KDR, FLT4, FLT1 MAPKAPK2 970/4885GRM4 4217/4885KDR 1/4885
US-20070270427-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 MAPKAPK2 970/4885GRM4 4217/4885KDR 1/4885

“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.