SCHEMBL8237753

SCHEMBL8237753

Cc1ccncc1NC(=O)c1ccnc2[nH]c(-c3ccc(N(C)C)cc3)nc12

nearest known ligand 0.61

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 12/20 0.61
GSK3A P49840 3/20 0.57
AURKA O14965 2/20 0.45
PARP1 P09874 1/20 0.41
MAPT P10636 1/20 0.39
ABL1 P00519 1/20 0.39
BCR P11274 1/20 0.39
HDAC1 Q13547 1/20 0.38

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
SCHEMBL4152895 0.90 GSK3B (0.60) GSK3BGSK3AMAPT
SCHEMBL4161701 0.88 GSK3B (0.59) GSK3BGSK3AMAPT
SCHEMBL4147509 0.88 GSK3B (0.59) GSK3BGSK3AMAPT
SCHEMBL4148191 0.86 GSK3B (0.61) GSK3BGSK3AMAPT
SCHEMBL4169267 0.86 GSK3B (0.76) GSK3BGSK3APARP1
SCHEMBL4152202 0.85 GSK3B (0.56) GSK3BGSK3A
SCHEMBL4152121 0.84 GSK3B (0.53) GSK3BGSK3A
SCHEMBL4152889 0.83 GSK3B (0.52) GSK3BGSK3A
SCHEMBL4152265 0.83 GSK3B (0.56) GSK3BAURKAPARP1MAPT
SCHEMBL4153410 0.83 GSK3B (0.59) GSK3BGSK3AAURKAMAPT

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 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
WO-2007083978-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME CRYSTALGENOMICS, INC. (KR) 2007-07-26 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-20090170847-A1 Imidazopyridine Derivatives Inhibiting Protein Kinase Activity, Method for the Preparation Thereof and Pharmaceutical Composition Containing Same GSK3B, GSK3A, MAP3K3 GSK3B 1/4885GSK3A 2/4885AURKA 29/4885

“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.