SCHEMBL13616209

SCHEMBL13616209

O=C1NC(=O)C(c2cn(C[18F])c3ncccc23)=C1c1cnccn1

nearest known ligand 0.78

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 18/20 0.78
PRKCB P05771 10/20 0.54
PRKCA P17252 5/20 0.52
PRKCG P05129 3/20 0.52
CCNA2 P20248 3/20 0.48
CDK2 P24941 3/20 0.48
CCNB2 O95067 2/20 0.48
CDK1 P06493 2/20 0.48
CCNB1 P14635 2/20 0.48
CCNA1 P78396 2/20 0.48
CCNB3 Q8WWL7 2/20 0.48
CCNT1 O60563 1/20 0.47
PIM1 P11309 1/20 0.47
CDK9 P50750 1/20 0.47
CDK5 Q00535 1/20 0.47
CDK5R1 Q15078 1/20 0.47
RPS6KA3 P51812 1/20 0.47
CAMK2D Q13557 1/20 0.46

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
SCHEMBL11937057 1.00 GSK3B (0.78) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL11937056 0.89 GSK3B (0.74) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL462891 0.88 GSK3B (1.00) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL2979250 0.83 GSK3B (0.78) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL13204273 0.83 GSK3B (0.78) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL2986746 0.83 GSK3B (0.78) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL11940755 0.81 GSK3B (0.61) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL13204232 0.77 GSK3B (0.67) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL4354893 0.75 GSK3B (1.00) GSK3BPRKCBPRKCAPRKCGCCNA2
SCHEMBL29541048 0.73 FLT3 (0.58) GSK3BPRKCBPRKCAPRKCGCCNA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090285756-A1 11C/18 F-LABELED INHIBITORS OF GLYCOGEN SYNTHASE KINASE-3 KARIMI FARHAD 2009-11-19 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-20090285756-A1 11C/18 F-LABELED INHIBITORS OF GLYCOGEN SYNTHASE KINASE-3 GSK3B, GSK3A, GSKIP GSK3B 1/4885PRKCB 24/4885PRKCA 38/4885

“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.