SCHEMBL3850103

SCHEMBL3850103

CCOC(=O)c1c(O)c(-c2ccc(F)cc2)nn(Cc2ccc(-c3ccccc3)cc2)c1=O

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.52
PDE4B Q07343 4/20 0.52
PDE4C Q08493 4/20 0.52
PDE4D Q08499 4/20 0.52
F2RL3 Q96RI0 1/20 0.49
MAPK1 P28482 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
POLB P06746 1/20 0.46
TP53 P04637 1/20 0.46
ALDH1A1 P00352 2/20 0.45
KDM4E B2RXH2 1/20 0.45
HPGD P15428 1/20 0.45
EGLN3 Q9H6Z9 1/20 0.45
NPSR1 Q6W5P4 2/20 0.45
ADORA1 P30542 1/20 0.45
TDP1 Q9NUW8 1/20 0.44
CYP19A1 P11511 1/20 0.43
GAA P10253 1/20 0.43
MMP1 P03956 1/20 0.43
MMP13 P45452 1/20 0.43

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
SCHEMBL3847510 0.91 EGLN3 (0.55) PDE4APDE4BPDE4CPDE4DF2RL3
SCHEMBL3851363 0.91 PDE4A (0.61) PDE4APDE4BPDE4CPDE4DF2RL3
SCHEMBL3849543 0.86 ALDH1A1 (0.47) PDE4APDE4BPDE4CPDE4DF2RL3
SCHEMBL3851331 0.86 EGLN3 (0.58) PDE4APDE4BPDE4CPDE4DF2RL3
SCHEMBL4123420 0.84 PDE4A (0.44) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL3854878 0.83 ALDH1A1 (0.46) PDE4APDE4BPDE4CPDE4DF2RL3
SCHEMBL3845820 0.82 EGLN3 (0.61) PDE4APDE4BPDE4CPDE4DF2RL3
SCHEMBL14006532 0.82 ALDH1A1 (0.42) PDE4APDE4BPDE4CPDE4DMAPK1
SCHEMBL3849282 0.82 MAPK1 (0.48) PDE4APDE4BPDE4CPDE4DF2RL3
SCHEMBL3849121 0.82 MAPK1 (0.48) PDE4APDE4BPDE4CPDE4DF2RL3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2889289-A1 Pyridazine-dione N-substituted glycine derivatives as HIF hydroxylase inhibitors GlaxoSmithKline LLC (US) 2015-07-01 EP disclosed
US-RE44613-E1 N-substituted glycine derivatives: hydroxylase inhibitors GLAXOSMITHKLINE LLC (US) 2013-11-26 US disclosed
EP-2124565-A2 N-SUBSTITUTED GLYCINE DERIVATIVES: HYDROXYLASE INHIBITORS Smithkline Beecham Corporation (US) 2009-12-02 EP disclosed
US-7608621-B2 Such as n-{[2-[(4-bromo-2-fluorophenyl)methyl]-5-hydroxy-6-(1-methylethyl)-3-oxo-2,3-dihydro-4-pyridazinyl]carbonyl}glycine; anemia; increasing erythropoietin production SMITHKLINE BEECHAM, CORP. (US) 2009-10-27 US disclosed
US-20080214549-A1 N-Substituted Glycine Derivatives: Hydroxylase Inhibitors GLAXOSMITHKLINE LLC 2008-09-04 US disclosed
WO-2008089052-A2 N-SUBSTITUTED GLYCINE DERIVATIVES: HYDROXYLASE INHIBITORS SMITHKLINE BEECHAM CORPORATION (US) 2008-07-24 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-20080214549-A1 N-Substituted Glycine Derivatives: Hydroxylase Inhibitors EGLN2, EGLN3, HIF1AN PDE4A 3240/4885PDE4B 4038/4885PDE4C 4166/4885

“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.