SCHEMBL4153576

SCHEMBL4153576

O=C(Nc1ccccc1)c1ccnc2[nH]c(-c3ccc(NC4CCNCC4)cc3)nc12

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
DHODH Q02127 3/20 0.43
PRMT5 O14744 1/20 0.41
GSK3B P49841 1/20 0.41
PBK Q96KB5 1/20 0.40
NR2E3 Q9Y5X4 3/20 0.39
MMP2 P08253 1/20 0.39
MMP9 P14780 1/20 0.39
MMP8 P22894 1/20 0.39
MMP13 P45452 1/20 0.39
MAP4K3 Q8IVH8 1/20 0.39
CCNC P24863 2/20 0.38
CDK8 P49336 2/20 0.38
HDAC1 Q13547 1/20 0.38
HPSE Q9Y251 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
SCHEMBL4153562 0.85 PBK (0.47) DHODHPBK
SCHEMBL4164571 0.85 PBK (0.47) DHODHPBK
SCHEMBL4152155 0.83 GSK3B (0.48) DHODHPRMT5GSK3BMMP2MMP9
SCHEMBL4152144 0.80 GSK3B (0.60) PRMT5GSK3BMMP2MMP9MMP8
SCHEMBL4149979 0.79 PRMT5 (0.57) PRMT5NR2E3MMP2MMP9MMP8
SCHEMBL4167122 0.79 PBK (0.42) PRMT5GSK3BPBKCCNCCDK8
SCHEMBL13778178 0.77 MEN1 (0.39) DHODHPBK
SCHEMBL4160366 0.77 DHODH (0.48) DHODHGSK3BPBK
SCHEMBL4152711 0.76 MAPK10 (0.54)
SCHEMBL4144903 0.75 RAD52 (0.46) DHODHPRMT5GSK3BMMP2MMP9

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
EP-1984370-A1 IMIDAZOPYRIDINE DERIVATIVES INHIBITING PROTEIN KINASE ACTIVITY, METHOD FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITION CONTAINING SAME Crystalgenomics, Inc. (KR) 2008-10-29 EP claimed
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 claimed

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 DHODH 3332/4885PRMT5 882/4885GSK3B 1/4885

“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.