SCHEMBL4156911

SCHEMBL4156911

O=C(NCCc1cccc[n+]1[O-])c1ccnc2[nH]c(-c3ccsc3)nc12

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 12/20 0.44
GSK3A P49840 1/20 0.44
HIF1A Q16665 1/20 0.37
MET P08581 1/20 0.37
RAD52 P43351 1/20 0.35
UHRF1 Q96T88 1/20 0.35
WNT1 P04628 1/20 0.34
CHEK1 O14757 2/20 0.34
CHEK2 O96017 2/20 0.34
PBK Q96KB5 2/20 0.34

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
SCHEMBL4152082 0.89 GSK3B (0.48) GSK3BHIF1ARAD52UHRF1PBK
SCHEMBL4160345 0.85 GSK3B (0.50) GSK3BHIF1ARAD52UHRF1PBK
SCHEMBL4161271 0.85 PBK (0.48) GSK3BPBK
SCHEMBL4159101 0.85 GSK3B (0.52) GSK3BGSK3AMETCHEK1CHEK2
SCHEMBL4147630 0.83 GSK3B (0.49) GSK3BGSK3AMETRAD52UHRF1
SCHEMBL4145538 0.83 GSK3B (0.51) GSK3BGSK3AMET
SCHEMBL4144878 0.83 GSK3B (0.47) GSK3BGSK3AMET
SCHEMBL4152663 0.82 GSK3B (0.46) GSK3B
SCHEMBL4166883 0.82 GSK3B (0.47) GSK3BGSK3AHIF1AMETRAD52
SCHEMBL4167099 0.81 GSK3B (0.55) GSK3BGSK3AHIF1ARAD52UHRF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same YUYU PHARMA, INC. (KR) 2009-07-02 US claimed
US-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same YUYU PHARMA, INC. (KR) 2009-07-02 US disclosed
US-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same YUYU PHARMA, INC. (KR) 2009-07-02 US 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-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same GSK3B, GSK3A, MAP3K3 GSK3B 1/4885GSK3A 2/4885HIF1A 3764/4885

“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.