SCHEMBL4696898

SCHEMBL4696898

CCCn1c(=O)cc(N(N)CC)[nH]c1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 1/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
GLA P06280 1/20 0.40
MAPT P10636 1/20 0.40
PDE4A P27815 6/20 0.39
ADORA2A P29274 6/20 0.39
PDE4B Q07343 6/20 0.39
PDE4C Q08493 6/20 0.39
PDE4D Q08499 6/20 0.39
TSHR P16473 1/20 0.38
HSD17B10 Q99714 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
CASP1 P29466 1/20 0.37
BRCA1 P38398 1/20 0.37
CASP7 P55210 1/20 0.37
ADORA3 P0DMS8 3/20 0.36
ADORA2B P29275 3/20 0.36
ADORA1 P30542 2/20 0.36
HPGD P15428 2/20 0.36

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
SCHEMBL3292106 0.82 KDM4C (0.57) KDM4CSMN1; SMN2TSHRHSD17B10MEN1
SCHEMBL3473479 0.77 TSHR (0.49) KDM4CSMN1; SMN2GLAMAPTPDE4A
SCHEMBL1546096 0.75 MAPT (0.49) SMN1; SMN2GLAMAPTPDE4AADORA2A
SCHEMBL4467734 0.73 TSHR (0.43) SMN1; SMN2GLAMAPTPDE4AADORA2A
SCHEMBL31268559 0.73 KDM4C (0.45) KDM4CSMN1; SMN2ADORA2ATSHRHSD17B10
SCHEMBL9765877 0.72 SMN1; SMN2 (0.42) SMN1; SMN2GLAMAPTPDE4AADORA2A
SCHEMBL3297433 0.71 KMT2A (0.54) SMN1; SMN2GLAMAPTPDE4AADORA2A
SCHEMBL3294722 0.71 SMN1; SMN2 (0.61) KDM4CSMN1; SMN2HSD17B10MEN1KMT2A
SCHEMBL31268552 0.71 KDM4C (0.43) KDM4CSMN1; SMN2MAPTADORA2AHSD17B10
SCHEMBL31268548 0.70 KDM4C (0.42) KDM4CSMN1; SMN2HSD17B10MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7737144-B2 Pyrimido[5,4-e][1,2,4]triazine-5-7-diones, processes for preparing them and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-06-15 US disclosed
US-7737144-B2 Pyrimido[5,4-e][1,2,4]triazine-5-7-diones, processes for preparing them and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2010-06-15 US disclosed
EP-1587806-B1 PYRIMIDO 5,4-E 1,2,4 TRIAZINE-5,7-DIONES, METHODS FOR PRODUCING THE SAME AND THEIR USE SANOFI AVENTIS DEUTSCHLAND (DE) 2008-11-12 EP disclosed
EP-1587806-B1 PYRIMIDO 5,4-E 1,2,4 TRIAZINE-5,7-DIONES, METHODS FOR PRODUCING THE SAME AND THEIR USE SANOFI AVENTIS DEUTSCHLAND (DE) 2008-11-12 EP disclosed
US-20080032984-A1 Pyrimido[5,4-e][1,2,4]triazine-5,7-diones, processes for preparing them and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-02-07 US disclosed
US-20080032984-A1 Pyrimido[5,4-e][1,2,4]triazine-5,7-diones, processes for preparing them and their use SANOFI-AVENTIS DEUTSCHLAND GMBH (DE) 2008-02-07 US disclosed
EP-1587806-A1 PYRIMIDO 5,4-E] 1,2,4]TRIAZINE-5,7-DIONES, METHODS FOR PRODUCING THE SAME AND THEIR USE Aventis Pharma Deutschland GmbH (DE) 2005-10-26 EP disclosed
WO-2004065387-A1 PYRIMIDO[5,4-E][1,2,4]TRIAZINE-5,7-DIONES, METHODS FOR PRODUCING THE SAME AND THEIR USE AVENTIS PHARMA DEUTSCHLAND GMBH (DE) 2004-08-05 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-20080032984-A1 Pyrimido[5,4-e][1,2,4]triazine-5,7-diones, processes for preparing them and their use CYP3A5, DPP4, DHPS KDM4C 1928/4885SMN1; SMN2 2952/4885GLA 3326/4885

“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.