SCHEMBL4169308

SCHEMBL4169308

C[S+]([O-])Cc1ccc(-c2nc3c(C(=O)Nc4cccnc4)ccnc3[nH]2)cc1

nearest known ligand 0.52

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 3/20 0.52
EGLN1 Q9GZT9 1/20 0.44
TRPV1 Q8NER1 3/20 0.42
NAMPT P43490 3/20 0.41
ALDH1A1 P00352 2/20 0.41
HTT P42858 1/20 0.41
SGMS2 Q8NHU3 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CLK2 P49760 1/20 0.40
LRRK2 Q5S007 4/20 0.40
TSHR P16473 1/20 0.39
HSD17B10 Q99714 1/20 0.39
KDM4E B2RXH2 1/20 0.39
MEN1 O00255 1/20 0.39
HPGD P15428 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL4156450 0.82 GSK3B (0.74) GSK3BEGLN1ALDH1A1HTTSGMS2
SCHEMBL4152265 0.82 GSK3B (0.56) GSK3BEGLN1NAMPTALDH1A1HTT
SCHEMBL4169328 0.81 GSK3B (0.55) GSK3BEGLN1TRPV1NAMPTALDH1A1
SCHEMBL3945101 0.79 PARP1 (0.51) GSK3BNPC1RAB9ATSHR
SCHEMBL4160814 0.77 LRRK2 (0.53) GSK3BNPC1RAB9ALRRK2TSHR
SCHEMBL4152109 0.77 GSK3B (0.53) GSK3BEGLN1ALDH1A1HTTNPC1
SCHEMBL4150197 0.77 GSK3B (0.75) GSK3BEGLN1NAMPTALDH1A1HTT
SCHEMBL4169323 0.76 CYP11B2 (0.43) GSK3BEGLN1NAMPTALDH1A1HTT
SCHEMBL4152912 0.76 TP53 (0.53) GSK3BNPC1RAB9AKMT2A
SCHEMBL4162865 0.75 GSK3B (0.56) GSK3BEGLN1NAMPTALDH1A1HTT

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 4 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
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 1/4885EGLN1 3684/4885TRPV1 2376/4885

“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.