SCHEMBL414092

SCHEMBL414092

Cc1cccc(-c2nc3ccccn3c2-c2ccnc(NCCCN3CCOCC3)n2)n1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.50
CDK4 P11802 3/20 0.48
TRIM33 Q9UPN9 2/20 0.48
TRIM24 O15164 1/20 0.48
GSK3B P49841 1/20 0.48
MKNK1 Q9BUB5 4/20 0.47
IGF1R P08069 2/20 0.45
TGFBR1 P36897 2/20 0.45
ADRA1B P35368 1/20 0.44
CCNE1 P24864 2/20 0.43
CDK2 P24941 2/20 0.43
SALL4 Q9UJQ4 1/20 0.42
EIF2AK2 P19525 1/20 0.42
RAC1 P63000 1/20 0.42
STK4 Q13043 1/20 0.41
STK3 Q13188 1/20 0.41
SIK2 Q9H0K1 1/20 0.41
STK26 Q9P289 1/20 0.41
STK24 Q9Y6E0 1/20 0.41
HIF1A Q16665 1/20 0.41

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
SCHEMBL413527 0.95 TRIM33 (0.54) KDM4ECDK4TRIM33TRIM24MKNK1
SCHEMBL412819 0.92 CDK2 (0.44) KDM4ECDK4GSK3BMKNK1IGF1R
SCHEMBL29832779 0.92 MKNK1 (0.50) KDM4ECDK4MKNK1IGF1RCCNE1
SCHEMBL409792 0.92 MKNK1 (0.50) KDM4ECDK4MKNK1IGF1RCCNE1
SCHEMBL414313 0.89 CDK2 (0.42) KDM4ECDK4MKNK1IGF1RTGFBR1
SCHEMBL415283 0.84 CDK2 (0.49) CDK4GSK3BCCNE1CDK2
SCHEMBL414098 0.83 CDK2 (0.48) CDK4GSK3BCCNE1CDK2
SCHEMBL411797 0.83 CDK2 (0.44) KDM4ECDK4GSK3BCCNE1CDK2
SCHEMBL5138510 0.81 CDK2 (0.53) CDK4GSK3BIGF1RCCNE1CDK2
SCHEMBL3360699 0.81 HDAC1 (0.54) CDK4MKNK1CCNE1CDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1804801-A2 METHODS OF TREATING VASCULAR INJURIES Biogen Idec MA, Inc. (US) 2007-07-11 EP claimed
US-20060135517-A1 Imidazolopyridines and methods of making and using the same BIOGEN IDEC MA INC. 2006-06-22 US claimed
EP-1546112-A4 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME BIOGEN IDEC INC (US) 2006-06-07 EP claimed
WO-2006044509-A2 METHODS OF TREATING VASCULAR INJURIES BIOGEN IDEC MA INC. (US) 2006-04-27 WO claimed
EP-1546112-A2 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME Biogen Idec MA Inc. (US) 2005-06-29 EP claimed
WO-2004021989-A2 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME BIOGEN IDEC MA INC. (US) 2004-03-18 WO claimed
US-20140120621-A1 TGF-BETA RECEPTOR INHIBITORS TO ENHANCE DIRECT REPROGRAMMING THE GENERAL HOSPITAL CORPORATION (US) 2014-05-01 US disclosed
US-8603818-B1 TGF-beta receptor inhibitors to enhance direct reprogramming THE GENERAL HOSPITAL CORPORATION (US) 2013-12-10 US disclosed
US-8298825-B1 TGF-beta receptor inhibitors to enhance direct reprogramming THE GENERAL HOSPITAL CORPORATION (US) 2012-10-30 US disclosed
US-20120021519-A1 EFFICIENT INDUCTION OF PLURIPOTENT STEM CELLS USING SMALL MOLECULE COMPOUNDS PRESIDENTS AND FELLOWS OF HARVARD COLLEGE (US) 2012-01-26 US disclosed
WO-2008013928-A2 TREATMENT OF CANCER WITH INTERFERON GENE DELIVERY IN COMBINATION WITH A TGF-BETA INHIBITOR BIOGEN IDEC MA INC. (US) 2008-01-31 WO disclosed
EP-1804801-A2 METHODS OF TREATING VASCULAR INJURIES Biogen Idec MA, Inc. (US) 2007-07-11 EP disclosed
US-20060135517-A1 Imidazolopyridines and methods of making and using the same BIOGEN IDEC MA INC. 2006-06-22 US disclosed
EP-1546112-A4 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME BIOGEN IDEC INC (US) 2006-06-07 EP disclosed
WO-2006044509-A2 METHODS OF TREATING VASCULAR INJURIES BIOGEN IDEC MA INC. (US) 2006-04-27 WO disclosed
EP-1546112-A2 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME Biogen Idec MA Inc. (US) 2005-06-29 EP disclosed
WO-2004021989-A2 IMIDAZOLOPYRIDINES AND METHODS OF MAKING AND USING THE SAME BIOGEN IDEC MA INC. (US) 2004-03-18 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 (1 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-20060135517-A1 Imidazolopyridines and methods of making and using the same ALK, ACVR1, ACVRL1 KDM4E 52/4885CDK4 116/4885TRIM33 564/4885

“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.