SCHEMBL585538

SCHEMBL585538

Cn1nc2cc([N+](=O)[O-])ccc2c1CO

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 10/20 0.48
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
LMNA P02545 2/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
F2R P25116 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
F2RL3 Q96RI0 1/20 0.47
POLB P06746 5/20 0.44
ALDH1A1 P00352 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.42
ATM Q13315 1/20 0.40
HTT P42858 2/20 0.40
MAPK1 P28482 1/20 0.40
TXNRD1 Q16881 1/20 0.40
TXNRD3 Q86VQ6 1/20 0.40
TXNRD2 Q9NNW7 1/20 0.40
NPC1 O15118 1/20 0.39
NFKB1 P19838 1/20 0.39
CASP3 P42574 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
SCHEMBL13106368 0.87 MAPT (0.49) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL589194 0.86 MAPT (0.48) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL27566549 0.83 MAPT (0.46) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL28996878 0.81 MAPT (0.51) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL588588 0.79 MAPT (0.53) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL22473631 0.78 MAPT (0.51) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL2842932 0.77 MAPT (0.48) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL588388 0.76 L3MBTL1 (0.42) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL27546495 0.75 MAPT (0.49) MAPTMEN1KMT2ALMNASMN1; SMN2
SCHEMBL13106411 0.75 L3MBTL1 (0.49) MAPTMEN1KMT2ALMNAPOLB

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
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-20070292513-A1 CHEMICAL COMPOUNDS NOVARTIS AG (CH) 2007-12-20 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
CN-1307173-C Pyrimidinamines as angiogenesis modulators GLAXO GROUP LTD (GB) 2007-03-28 CN 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
CN-1549813-A Pyrimidinamines as angiogenesis modulators 2004-11-24 CN 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 MAPT 3924/4885MEN1 4640/4885KMT2A 1430/4885
US-20070015756-A1 Chemical compounds KDR, FLT4, FLT1 MAPT 3547/4885MEN1 3177/4885KMT2A 1583/4885
US-20100105712-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 MAPT 3547/4885MEN1 3177/4885KMT2A 1583/4885
US-20120277258-A1 Chemical Compounds KDR, FLT4, FLT1 MAPT 3547/4885MEN1 3177/4885KMT2A 1583/4885
US-20070270427-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 MAPT 3547/4885MEN1 3177/4885KMT2A 1583/4885
US-20070292513-A1 CHEMICAL COMPOUNDS KDR, FLT4, FLT1 MAPT 3547/4885MEN1 3177/4885KMT2A 1583/4885

“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.