SCHEMBL6869715

SCHEMBL6869715

COC(=O)c1ccnc(N(C(C)=O)C(C)=O)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.54
KDM4C Q9H3R0 2/20 0.54
KDM6B O15054 1/20 0.54
KDM5C P41229 1/20 0.54
KDM2A Q9Y2K7 1/20 0.54
KDM3A Q9Y4C1 1/20 0.54
ALOX15 P16050 2/20 0.50
L3MBTL1 Q9Y468 2/20 0.50
JMJD6 Q6NYC1 1/20 0.48
HTT P42858 1/20 0.44
HPGD P15428 2/20 0.44
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 5/20 0.44
MAPK1 P28482 2/20 0.44
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42

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
SCHEMBL14064494 0.84 KDM4E (0.51) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL16711033 0.81 KDM4E (0.48) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL22000176 0.81 KDM4E (0.48) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL6867494 0.80 MLYCD (0.38) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL29894587 0.75 KDM4E (0.86) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL70279 0.75 KDM4E (0.86) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL30378954 0.75 KDM4E (0.58) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1759313 0.75 KDM4E (0.58) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL200699 0.74 KDM4E (0.62) KDM4EKDM4CKDM6BKDM5CKDM2A
SCHEMBL1180311 0.74 KDM4E (0.62) KDM4EKDM4CKDM6BKDM5CKDM2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1347974-B1 AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS HOFFMANN LA ROCHE (CH) 2004-11-03 EP disclosed
CN-1486314-A Aminotriazolopyridine derivatives as adenosine receptor ligands - 2004-03-31 CN disclosed
EP-1347974-A1 AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2003-10-01 EP disclosed
US-6506772-B1 Pharmaceutically active salts thereof with activity as adenosine receptor ligands are disclosed. These compounds are the adenosine receptor. HOFFMANN-LA ROCHE INC. 2003-01-14 US disclosed
WO-2002048145-A1 AMINOTRIAZOLOPYRIDIINE DERIVATIVES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2002-06-20 WO disclosed